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["Material","MP_ID","ICSD_ID","Calculated and experimental band gaps. All numbers in eV.",{"$nulls":15},"DOI for the experimental references (missing entries refer to values as provided by 10.1007/978-3-642-18865-7, Semiconductors: Data Handbook, Otfried Madelung, Springer-Verlag Berlin Heidelberg, 2004)"]
[null,null,null,"LDA","LDA + SOC","PBE","PBE + SOC","PBE_SOL","HLE16","HLE16 + SOC","BJ","MBJ","SCAN","HSE06","HSE14","HSE06_mix","PBE0","PBE0_mix","Experimental"]
["Ag2CrO4","mp-557056",16298,1.3436,1.3238,1.413,1.3914,1.3842,1.8604,1.8573,1.566,1.7602,1.5574,2.5549,3.0619,3.8938,2.829,3.9702,1.75,"10.1021/jp077127w"]
["Ag2GeS3","mp-9900",41711,0.0421,0.0495,0.1257,0.1156,0.0429,0.9641,0.9581,0.5081,1.0731,0.3162,1.0802,1.3883,1.475,1.7287,1.8021,1.98,"10.1016/j.saa.2012.03.044"]
["Ag2MoO4","mp-19318",238013,2.0985,2.0183,2.2497,2.1712,2.126,4.1954,4.1524,2.9429,3.9113,2.6264,3.9265,4.6616,5.3773,4.6367,6.0903,3.4,"10.1039/C5TA05248C"]
["Ag2O","mp-353",247821,0.0117,0.1254,0.026,0.1232,0,0.7445,0.6234,0.3027,0.4661,0.2562,1.198,1.5406,1.9769,1.8781,2.516,1.3,"10.1103/PhysRevB.41.3190"]
["Ag2PdO2","mp-5495",51498,0,0,0.0446,0.0382,0,0.7223,0.7541,0.4835,0.9604,0.3055,1.2216,1.6413,2.076,1.8945,2.6334,0.18,"10.1016/S1293-2558(00)01128-6"]
["Ag2S","mp-610517",44507,0.6435,0.624,0.7015,0.6765,0.6685,1.1323,1.1544,0.8157,1.0404,0.8849,1.3354,1.4903,1.5665,1.7797,1.6508,0.85]
["Ag2Se","mp-568936",260148,0.0109,0.0028,0.0017,0.0109,0.0069,0.0259,0.0802,0.0299,0.0527,0.006,0.005,0.0226,0.0194,0.0205,0.0222,0.15]
["Ag3AsS3","mp-4431",61806,0.919,0.9151,1.0377,1.0232,0.9512,1.965,1.9568,1.2713,1.5697,1.256,1.8368,1.9956,2.0704,2.4991,2.3167,2.133,"10.1088/0953-8984/1/9/011"]
["Ag3SbS3","mp-4515",64986,0.7917,0.7858,0.912,0.8966,0.8215,1.9076,1.8736,1.1918,1.4869,1.1417,1.6809,1.8415,1.8847,2.3313,2.1065,1.93]
["Ag5IO6","mp-554648",415893,0,0,0,0,0,0.715,0.7176,0.2223,0.7246,0.127,1.0262,1.6651,2.0487,1.6649,2.5668,1.4,"10.1002/zaac.200500476"]
["AgAlO2","mp-11794",99688,0.7757,0.7284,0.8906,0.8417,0.7874,2.8977,2.8981,1.5804,2.2714,1.2361,2.422,3.1775,3.585,2.8908,3.6644,2.952,"10.1063/1.4718342"]
["AgAlS2","mp-5782",604692,1.91,1.8964,2.1233,2.1073,2.0006,3.6409,3.6443,2.6005,3.1894,2.5863,3.3278,3.6784,3.6794,3.8922,3.7563,3.13,"10.1088/0022-3727/4/8/319"]
["AgAlSe2","mp-14091",604704,0.8204,0.7886,1.0503,1.019,0.9402,2.1914,2.1466,1.4828,2.0714,1.4602,2.0664,2.3968,2.2946,2.4568,2.3324,2.55,"10.1088/0022-3727/4/8/319"]
["AgAlTe2","mp-14092",28746,0.9898,0.8251,1.1699,1.0092,1.0847,1.8419,1.6364,1.4958,1.9638,1.4711,2.044,2.2627,2.1838,2.6443,2.2097,2.35,"10.1103/PhysRevB.9.5203"]
["AgBiP2S6","mp-556434",170639,1.0232,0.8395,1.143,0.94,1.0671,1.663,1.2118,1.2776,1.5922,1.2724,1.9517,2.0993,2.1532,2.5289,2.2529,1.7,"10.1021/ic050357%2B"]
["AgBiP2Se6","mp-569126",195334,1.2172,1.0055,1.3667,1.1292,1.2957,1.8021,1.3339,1.5948,1.9656,1.605,2.0772,2.2109,2.2099,2.4092,2.1199,1.4,"10.1021/ic050357%2B"]
["AgBr","mp-23231",65061,0.3998,0.3131,0.7018,0.6184,0.5328,3.0609,2.9274,1.4619,2.4181,1.1633,2.0503,2.6914,2.6115,2.6619,2.8573,2.7125]
["AgCl","mp-22922",64734,0.6337,0.5958,0.932,0.8919,0.7526,3.5954,3.5789,1.7618,2.8275,1.3853,2.428,3.1222,3.2682,3.0648,3.6676,3.248]
["AgF","mp-7592",18008,0,0,0,0,0,2.8098,2.7581,0.6888,2.146,0,1.3447,2.4054,3.4053,2.0527,4.0904,2.8,"10.1039/B211678B"]
["AgGaS2","mp-5342",605187,1.0165,1.0083,1.2432,1.2304,1.1288,2.5881,2.5823,1.7559,2.5022,1.644,2.4202,2.8348,2.8872,2.9515,3.0952,2.714,"10.1103/PhysRevB.4.4455"]
["AgGaSe2","mp-5518",52570,0.3245,0.2818,0.5674,0.5247,0.4624,1.6887,1.6277,1.0053,1.7489,0.8907,1.6111,2.0151,1.9568,2.0538,2.1304,1.814]
["AgGaTe2","mp-4899",71007,0.1374,0.0421,0.3177,0.1404,0.2427,0.955,0.7354,0.5983,1.1512,0.4645,1.163,1.4421,1.3755,1.7429,1.5153,1.32,"10.1007/s10853-005-6103-5"]
["AgI","mp-22894",56553,1.2592,1.0117,1.4941,1.2872,1.3734,3.4197,3.167,1.9491,2.599,1.7552,2.6024,2.9471,2.9891,3.1355,3.1882,3.0247]
["AgI","mp-22925",56552,1.0813,0.8486,1.357,1.1312,1.2168,3.4084,3.093,1.945,2.7209,1.6614,2.4956,2.8681,2.8943,3.1263,3.1855,2.91]
["AgInO2","mp-22660",202429,0.3248,0.3193,0.3973,0.3853,0.3173,1.551,1.5417,0.7933,1.2274,0.7011,1.6857,2.2115,2.7402,2.3624,3.3811,1.9,"10.1021/jp806513t"]
["AgInS2","mp-19833",51617,0.2969,0.2886,0.5254,0.5121,0.4068,1.8931,1.8883,0.988,1.6814,0.8403,1.592,1.9398,2.012,2.1805,2.2825,2.036,"10.1016/S0022-0248(02)01729-3"]
["AgInSe2","mp-20554",52583,0.1459,0.1359,0.0887,0.0461,0.0209,1.2616,1.1991,0.4844,1.1641,0.3631,1.0368,1.3777,1.3486,1.5103,1.5707,1.24,"10.1103/PhysRevB.7.4485"]
["AgInTe2","mp-22386",236191,0.0958,0.0672,0.2939,0.1002,0.2008,1.0531,0.8175,0.5503,1.1076,0.4586,1.1163,1.3599,1.3196,1.6659,1.4499,0.964]
["AgScP2Se6","mp-13383",195336,1.4876,1.4539,1.5618,1.5301,1.5229,1.8291,1.8341,1.714,1.9487,1.8492,2.5016,2.7028,2.7022,3.0089,2.6576,1.55,"10.1002/zaac.200900004"]
["Al2O3","mp-1143",31545,6.1417,6.1354,6.1905,6.1843,6.0981,6.959,6.9536,6.8962,7.8593,7.0343,8.0496,8.9851,9.4155,8.6634,9.9703,8.8,"10.1111/j.1151-2916.1990.tb06541.x"]
["AlAs","mp-2172",656315,1.3341,1.2338,1.4338,1.3363,1.3169,2.3471,2.2415,1.8199,2.154,1.7346,2.0668,2.0819,2.0883,2.7139,2.1103,2.229]
["AlN","mp-661",602460,4.1579,4.1577,4.1358,4.1358,4.0617,4.7771,4.7767,4.7612,5.2982,4.7918,5.4991,5.9637,5.9977,6.1665,6.1817,6.11,"10.1063/1.1633965"]
["AlP","mp-1550",52649,1.441,1.4203,1.5794,1.5594,1.4376,2.8388,2.818,1.9122,2.3152,1.8998,2.2848,2.3175,2.3182,2.9493,2.2923,2.45]
["AlPO4","mp-3955",50100,5.7,5.6981,5.9523,5.9454,5.8391,7.5791,7.5923,6.7914,8.2647,6.5059,7.8047,8.6471,9.7011,8.3533,10.3467,7.89,"10.1111/jace.12757"]
["AlSb","mp-2624",609288,1.1329,0.9156,1.207,0.9975,1.1079,1.5913,1.3628,1.5716,1.7972,1.372,1.7046,1.648,1.6971,2.3271,1.7523,1.686]
["Ar","mp-23155",24788,8.1777,8.1115,8.7053,8.6041,8.6221,11.7507,11.6798,9.6408,12.5453,9.4981,10.3432,10.9531,12.0017,10.6929,12.9635,14.15,"10.1016/0030-4018(86)90186-0"]
["As2S3","mp-641",15239,1.7649,1.7596,1.9051,1.8885,1.8258,2.3747,2.37,2.0176,2.429,2.1361,2.792,2.8936,2.9818,3.396,3.0435,2.6]
["As2Se3","mp-909",44058,1.1,1.09,1.2131,1.1936,1.1465,1.6946,1.6892,1.3738,1.6735,1.4702,1.9471,2.0203,2.0458,2.4616,2.0125,2.15]
["As2Te3","mp-484",196146,0.3962,0.2041,0.4183,0.2351,0.3946,0.6155,0.2911,0.5261,0.5658,0.4821,0.7501,0.7208,0.7624,1.2746,0.8025,0.9]
["AsI3","mp-23218",56571,2.0281,1.8509,2.0998,1.9294,2.0581,2.4245,2.1921,2.2617,2.4149,2.2776,2.8005,2.8198,2.953,3.3069,3.0351,2.47]
["B","mp-160",431643,0.9763,0.9763,1.0129,1.0143,0.9309,1.1359,1.1039,1.1408,1.2344,1.0858,1.5001,1.3918,1.4142,2.1787,1.0088,2,"10.1002/pssa.2210860164"]
["B12P2","mp-28395",62748,2.3674,2.3673,2.4245,2.418,2.3446,2.6965,2.696,2.5145,2.6375,2.6198,3.1548,3.1311,3.1149,3.8541,2.7977,3.35,"10.1016/0022-3697(83)90151-8"]
["Ba2BiInS5","mp-864638",261678,1.1115,1.0741,1.2996,1.2544,1.2138,2.0259,1.7629,1.488,2.0518,1.5341,2.1203,2.2435,2.3045,2.7727,2.4841,1.55,"10.1021/ic2004358"]
["Ba2Cu2ThSe5","mp-1078405",195762,0.6021,0.5621,0.677,0.6374,0.6042,0.9324,0.6681,0.9802,1.0684,0.8717,1.3854,1.4018,1.4897,1.8955,1.4611,1.75,"10.1021/acs.inorgchem.6b01202"]
["Ba2InTaO6","mp-1079630",261480,4.0222,3.9003,4.1272,3.9997,4.0616,3.9238,3.7645,4.4934,5.2906,4.53,5.6365,6.2196,6.6289,6.2389,6.5047,4.17,"10.1002/ejic.201500929"]
["Ba3MgTa2O9","mp-6325",240279,3.2278,3.1384,3.3521,3.2578,3.273,3.3296,3.2186,3.7251,4.5828,3.7631,4.793,5.3427,5.7423,7.9574,6.0888,4.28,"10.1016/j.jssc.2007.08.003"]
["Ba3ThSe7","mp-1095255",429804,0.7926,0.762,0.9077,0.8628,0.8453,1.3084,1.2719,1.0844,1.4045,1.1859,1.7596,1.8276,1.9035,2.2371,1.8511,1.96,"10.1016/j.jssc.2015.08.012"]
["BaAg2GeS4","mp-7394",10040,0.3998,0.3973,0.6132,0.6061,0.4986,2.0247,2.0204,1.0383,1.7067,0.9452,1.7044,2.0561,2.0345,2.3523,2.2102,2.02,"10.1039/c7dt04178k"]
["BaAg2SnS4","mp-555166",41898,0.2161,0.2134,0.4143,0.4041,0.3069,1.6178,1.5871,0.7787,1.3118,0.7125,1.3936,1.6983,1.6919,2.0145,1.871,1.77,"10.1039/c7dt04178k"]
["BaBiBS4","mp-861618",248222,1.8715,1.6797,2.0112,1.81,1.9323,2.3579,1.9552,2.0705,2.5068,2.1298,2.763,2.8365,2.9502,3.281,3.0361,2.34,"10.1021/ic100535q"]
["BaBiO2Cl","mp-552806",79532,3.1706,2.9915,3.3113,3.119,3.2137,4.2315,3.7233,3.6679,4.1712,3.5588,4.4119,4.6816,4.9603,5.046,5.3909,3.71,"10.1016/j.materresbull.2014.11.032"]
["BaCl2","mp-23199",262674,4.7648,4.7003,5.0347,4.972,4.8839,6.4944,6.4314,5.3746,6.3275,5.5449,6.3304,6.6402,6.8853,7.0678,6.8033,7,"10.1103/PhysRevB.9.2679"]
["BaCu2GeS4","mp-17947",10006,1.1525,1.1367,1.2685,1.2447,1.2119,2.1215,2.1516,1.7293,1.9151,1.5273,2.616,3.2199,3.0674,3.2742,3.1805,2.47,"10.1039/c7ra05022d"]
["BaCu2S2","mp-5970",89573,0.8029,0.7986,0.9115,0.9046,0.8361,2.1553,2.1476,1.428,1.5025,1.2648,2.1054,2.346,2.3387,2.7704,2.4586,2.1,"10.1021/acs.chemmater.7b02475"]
["BaCu2SnSe4","mp-12364",170857,0.4973,0.481,0.6113,0.6064,0.5607,1.2737,1.2713,0.9243,0.9948,0.7838,1.713,2.1558,1.9931,2.2843,1.8749,1.72,"10.1039/c7ra05022d"]
["BaCuTeF","mp-13287",245624,0.9383,0.7587,1.0214,0.8516,0.9705,2.2454,2.0229,1.4896,1.7035,1.2032,1.9805,2.2687,2.248,2.6128,2.4695,2.3,"10.1016/j.jssc.2007.03.021"]
["BaF2","mp-1029",64717,6.3929,6.3731,6.7858,6.767,6.6501,9.0251,9.0272,7.9502,9.4754,7.2365,8.7305,9.783,10.8007,9.1581,11.0745,9.1,"10.1201/9781420050196"]
["BaGe2","mp-2139",409260,0.4848,0.4844,0.5325,0.5313,0.4957,0.878,0.884,0.6054,0.7107,0.6717,0.9274,0.8515,0.9464,1.4951,1.0309,0.97,"10.1002/pssc.201300375"]
["BaHgS2","mp-28007",251739,1.147,1.1275,1.2705,1.2506,1.2056,1.7972,1.7894,1.406,1.8463,1.421,2.0652,2.2247,2.3044,2.5705,2.406,1.93,"10.1021/ic502939g"]
["BaO","mp-1342",616005,1.825,1.759,1.9602,1.898,1.855,3.4906,3.4304,2.5857,3.3572,2.2663,3.2427,3.633,3.8907,3.7569,4.2857,4.8,"10.1103/PhysRevB.81.245123"]
["BaS","mp-1500",52690,1.9035,1.8503,2.1004,2.0487,1.9756,3.4611,3.4089,2.4123,3.1219,2.4458,3.0272,3.1237,3.2175,3.5593,3.3085,3.806,"10.1016/0022-0248(90)90701-L"]
["BaSbBS4","mp-866301",248221,2.288,2.2667,2.4161,2.3895,2.3428,2.7869,2.7115,2.5461,2.9079,2.6283,3.2499,3.3422,3.4489,3.7716,3.4894,2.7,"10.1021/ic100535q"]
["BaSe","mp-1253",52696,1.7223,1.5752,1.8767,1.7339,1.7721,3.1936,3.0382,2.2556,2.7417,2.2448,2.7101,2.7733,2.8234,3.345,2.8901,3.421,"10.1016/0022-0248(90)90701-L"]
["BaSi2","mp-1477",185375,0.6684,0.6664,0.7401,0.7382,0.6879,1.2043,1.2018,0.7962,0.9335,0.9728,1.1888,1.1153,1.1522,1.7683,0.9754,1.15,"10.1063/1.1498865"]
["BaSnO3","mp-3163",239582,0.8375,0.8347,1.0057,0.9961,0.9138,1.0256,1.0223,1.5458,2.7677,1.6001,2.6972,3.6229,3.8294,3.355,4.2075,3.7,"10.1016/j.cap.2016.12.013"]
["BaTe","mp-1000",616165,1.3957,1.1119,1.5172,1.2413,1.4288,2.7602,2.4497,1.8791,2.1982,1.854,2.1938,2.1728,2.2236,2.809,2.2558,3.4,"10.1103/PhysRev.163.219"]
["BaTeMo2O9","mp-19049",281503,2.8525,2.8318,2.8548,2.8307,2.8375,2.5135,2.4958,3.0112,3.3726,3.1619,4.0697,4.3899,5.0906,4.6483,5.7327,2.95,"10.1021/cm2015143"]
["BaZn2As2","mp-570198",417000,0,0,0,0,0,0.5895,0.5243,0,0.2786,0,0.2079,0.2714,0.2457,0.8051,0.2848,0.23,"10.1021/ja507890u"]
["BaZnOS","mp-548469",171239,2.1065,2.0971,2.2764,2.2653,2.1543,3.6243,3.6158,2.6514,3.298,2.6274,3.3675,3.584,3.7456,4.002,4.0107,3.9,"10.1021/ic051240o"]
["BeO","mp-2542",391224,7.2867,7.2859,7.3489,7.3479,7.2072,8.6135,8.6128,8.228,9.1688,8.1636,9.2276,10.1596,11.0839,9.9622,11.8757,10.585]
["BeSe","mp-1541",616419,2.4711,2.3247,2.6254,2.4824,2.4817,4.1191,3.9618,3.0748,3.5342,3.0833,3.4726,3.587,3.6037,4.1525,3.7506,5.5,"10.1103/PhysRevB.59.10071"]
["BeTe","mp-252",616439,1.8607,1.5616,1.9646,1.6727,1.8497,3.2191,2.9349,2.3713,2.6449,2.2254,2.6061,2.5999,2.6413,3.2556,2.7404,2.8]
["Bi2O2CO3","mp-30200",252588,0,0,0,0,0,0,0,0,0.5895,0,0.3946,1.0821,1.5135,1.0844,2.0764,3.42,"10.1016/j.solidstatesciences.2014.01.010"]
["Bi2O3","mp-23262",94229,2.2869,2.1902,2.3845,2.2847,2.3084,3.0898,2.7907,2.7805,3.2332,2.5941,3.3894,3.6895,4.045,3.8273,4.6192,2.5,"10.1016/0301-0104(77)85033-7"]
["Bi2O3","mp-23195",189995,1.5106,1.4278,1.5696,1.4805,1.5092,2.2898,2.0989,1.9949,2.3439,1.8139,2.5593,2.8683,3.1853,3.0878,3.6511,2.28,"10.1016/S1872-2067(15)60974-3"]
["Bi2S3","mp-22856",153946,1.2736,0.9822,1.4129,1.0886,1.3306,1.8631,1.243,1.5462,1.9609,1.4997,2.0537,2.1133,2.1892,2.5599,2.2789,1.45]
["Bi2Se3","mp-541837",165226,0.0769,0.3157,0.2041,0.2819,0.1276,0.8501,0.0347,0.3614,0.6779,0.2456,0.6508,0.6962,0.7154,1.1659,0.8481,0.22,"10.1038/s41598-017-07211-x"]
["Bi2Te3","mp-34202",193330,0.1831,0.2596,0.2649,0.2722,0.2125,0.6747,0.1738,0.3686,0.5435,0.1872,0.6185,0.618,0.6419,1.107,0.7049,0.15,"10.1103/PhysRevB.46.1553"]
["BiCuOSe","mp-23116",189174,0.181,0.0146,0.3077,0.0976,0.2297,0.8382,0.5109,0.5776,0.7887,0.4698,1.2255,1.5209,1.5021,1.8167,1.6536,0.82,"10.1016/j.jssc.2011.11.013"]
["BiF3","mp-557466",25567,3.5875,2.9825,3.7269,3.0944,3.6328,3.8897,2.7692,4.3553,5.1871,4.0595,5.3917,6.2923,7.0344,6.1082,7.7884,3.94,"10.1016/j.molcata.2015.02.022"]
["BiI3","mp-22849",53634,2.2658,1.3626,2.4018,1.4676,2.3335,2.7249,1.3645,2.5753,2.8821,2.5321,3.1076,3.1487,3.255,3.6392,3.3914,1.67,"10.1063/1.4813486"]
["BiNSr3","mp-570008",152053,0.1856,0.0602,0.2106,0.015,0.1894,0.933,0.5846,0.5974,0.8555,0.4111,0.8689,0.9359,0.8939,1.4624,0.8744,0.89,"10.1002/zaac.200400256"]
["BiOBr","mp-23072",61225,2.0527,1.8305,2.1967,1.9727,2.0977,2.8636,2.4113,2.5711,3.1122,2.4468,3.1411,3.381,3.5001,3.7514,3.7986,2.924]
["BiOCl","mp-22939",195115,2.4605,2.266,2.617,2.4156,2.5045,3.4072,2.9789,3.0038,3.5969,2.8852,3.6379,3.9216,4.1254,4.2576,4.5122,3.455]
["BiOI","mp-22987",391354,1.4779,1.1847,1.619,1.3196,1.5286,1.9846,1.5315,1.8599,2.4283,1.8397,2.4012,2.5218,2.5993,3.0321,2.8193,1.89]
["BiSBr","mp-23324",31389,1.8113,1.427,1.9748,1.5515,1.879,2.4207,1.5637,2.0889,2.5843,2.0841,2.7083,2.7822,2.8937,3.1066,2.915,1.95]
["BiSCl","mp-23318",100173,1.6946,1.2631,1.8547,1.3804,1.7636,2.4581,1.586,1.9654,2.5053,1.9463,2.5971,2.6458,2.8492,3.2376,3.1947,1.89]
["BiSeBr","mp-569707",76649,0.9678,0.6328,1.0621,0.7105,1.01,1.4674,0.871,1.197,1.5147,1.1535,1.6918,1.6795,1.824,2.2924,2.0407,1.5]
["BiSeI","mp-23020",280311,1.4207,0.9345,1.5468,1.037,1.4752,1.8637,0.9326,1.6945,2.0257,1.6524,2.2082,2.2803,2.2996,2.7492,2.3165,1.3]
["BiSI","mp-23514",23631,1.6336,1.1156,1.7764,1.2331,1.6952,2.1154,1.1829,1.9036,2.2995,1.8963,2.5044,2.5872,2.6197,3.0088,2.6236,1.56]
["BN","mp-1639",77271,4.3315,4.3244,4.449,4.4418,4.2675,5.3307,5.3225,5.0027,5.7691,4.9267,5.7878,6.1924,6.3005,6.5552,6.5758,6.36,"10.1088/0953-8984/20/7/075233"]
["BN","mp-984",241875,4.0796,4.0797,4.2887,4.2897,4.1794,5.297,5.312,4.9021,5.956,4.7767,5.6187,6.0427,6.3854,6.2978,6.7243,5.96,"10.1088/0953-8984/20/7/075233"]
["BP","mp-1479",602964,1.2202,1.2064,1.2731,1.2596,1.1674,1.8883,1.8726,1.5706,1.9104,1.5831,2.015,2.0538,2.0331,2.694,1.8918,2.1]
["C","mp-66",190650,4.1212,4.1167,4.1509,4.1464,4.0339,4.5294,4.5079,4.473,4.9563,4.5689,5.3393,5.5927,5.6739,6.1009,5.8347,5.5]
["Ca2Pb","mp-30478",58920,0.1252,0.0744,0.1285,0.0783,0.1216,0.2721,0.1463,0.3777,0.4288,0.0988,0.4432,0.3744,0.3933,0.9797,0.28,0.46]
["Ca2Si","mp-2517",158275,0.2834,0.2832,0.3467,0.3461,0.3034,0.6746,0.6731,0.5038,0.6542,0.5603,0.7671,0.7094,0.7102,1.3289,0.4834,1.9]
["Ca2Sn","mp-22735",659611,0.1184,0.0982,0.1351,0.1156,0.1178,0.3498,0.3254,0.3675,0.4295,0.2905,0.4801,0.4147,0.4223,1.037,0.3105,0.9]
["Ca2SnS4","mp-866503",429695,2.2467,2.2285,2.4809,2.4551,2.3794,2.9682,2.9534,2.6335,3.3557,2.8401,3.5601,3.797,3.9344,4.0042,3.9449,2.32,"10.1016/j.jcrysgro.2015.10.032"]
["CaB6","mp-865",196516,0.0536,0.0536,0.0221,0.023,0.042,0.3513,0.5271,0.0076,0.2607,0.1052,0.5412,0.4945,0.554,1.196,0.5204,1.15,"10.1103/PhysRevLett.89.157601"]
["CaCl2","mp-23214",246416,5.1405,5.1386,5.4257,5.4145,5.3208,6.0947,6.0724,5.5679,6.7193,5.9942,6.9696,7.3395,7.7667,7.3876,8.3789,6.9,"10.1103/PhysRevB.9.2679"]
["CaCO3","mp-3953",52151,4.9364,4.9366,5.1491,5.1304,5.066,5.5431,5.5235,5.8208,7.1376,5.7704,7.1406,8.1024,9.2903,7.7298,9.9727,6,"10.1016/0169-4332(93)90365-I"]
["CaF2","mp-2741",82707,6.8955,6.8949,7.2807,7.2802,7.097,9.158,9.1887,8.446,10.4534,7.828,9.3438,10.531,12.4018,9.9042,13.1824,12.1,"10.1103/PhysRevB.5.662"]
["CaH2","mp-23713",260873,2.7181,2.7181,2.9964,2.9961,2.8092,3.5497,3.577,3.3531,4.2506,3.4591,4.0411,4.233,4.2769,4.7072,4.3924,4.4,"10.1021/jacs.7b05746"]
["CaMg2N2","mp-5795",79123,2.0949,2.0929,2.0867,2.0853,2.0358,2.7079,2.706,2.8259,3.3736,2.624,3.1411,3.4444,3.5634,3.7313,3.8353,3.25,"10.1515/znb-2003-0124"]
["CaO","mp-2605",261847,3.4622,3.4482,3.6327,3.618,3.5325,4.584,4.5702,4.1537,5.3752,4.1642,5.3115,6.0888,6.7248,6.009,7.3915,6.875,"10.1016/0022-0248(90)90701-L"]
["CaS","mp-1672",603165,2.1475,2.1157,2.3587,2.3272,2.2361,3.3572,3.3245,2.5223,3.338,2.8103,3.4243,3.6588,3.7089,4.1127,3.9062,4.434,"10.1016/0022-0248(90)90701-L"]
["CaSe","mp-1415",52788,1.8827,1.7455,2.0381,1.9046,1.9421,2.9812,2.8352,2.2802,2.864,2.5198,2.9946,3.1844,3.1669,3.6633,3.2695,3.85,"10.1016/0022-0248(90)90701-L"]
["CaSnO3","mp-4438",193658,2.6333,2.6357,2.7433,2.7409,2.6727,2.9691,2.9705,3.1962,4.1736,3.2686,4.288,5.105,5.7897,5.0097,5.7375,4.4,"10.1021/ic034551c"]
["CaZnOS","mp-7204",245309,2.5531,2.5308,2.7758,2.7534,2.636,4.341,4.31,3.3174,4.3473,3.2829,4.0048,4.4079,4.6237,4.6433,5.0711,3.7,"10.1021/ic062120z"]
["CdAl2S4","mp-5928",83526,2.6702,2.6698,2.9217,2.9031,2.7942,3.857,3.8655,3.2286,3.9987,3.3978,4.0924,4.3604,4.4267,4.5934,4.4477,3.577,"10.1063/1.118188"]
["CdAs2","mp-471",609931,0.1981,0.1948,0.3264,0.3209,0.2695,0.8017,0.7499,0.4277,0.892,0.5292,0.9894,1.1148,1.0991,1.5517,1.1656,0.995]
["CdGa2S4","mp-4452",31354,1.8491,1.8222,2.0751,2.0444,1.9711,2.895,2.8824,2.3861,3.1513,2.4714,3.1494,3.4544,3.5529,3.6592,3.706,3.31,"10.1016/0022-3697(93)90124-A"]
["CdGa2Se4","mp-3772",30908,1.2978,1.1609,1.5351,1.3991,1.4292,2.4134,2.269,1.8304,2.5437,1.9018,2.4736,2.7635,2.74,3.0549,2.9216,2.162,"10.1002/pssa.200406870"]
["CdGa2Te4","mp-13949",25646,1.1723,0.8806,1.3541,1.0669,1.2707,1.9507,1.6334,1.5808,2.0952,1.5873,2.1688,2.2413,2.3245,2.7565,2.4371,1.445,"10.1063/1.1845582"]
["CdGeAs2","mp-4953",42098,0.237,0.1819,0.1454,0.178,0.2099,0.1547,0.0934,0.0027,0.6691,0.015,0.6129,0.8702,0.807,1.1784,0.9544,0.673]
["CdGeP2","mp-3668",100467,0.751,0.7466,0.9457,0.9387,0.8775,1.3468,1.3419,1.1537,1.7988,1.199,1.8354,2.0316,2.0684,2.4545,2.2114,1.73]
["CdI2","mp-567259",43852,2.174,1.8744,2.369,2.0763,2.2875,3.2791,2.9566,2.6832,3.2785,2.7235,3.3319,3.5477,3.5622,3.8254,3.5861,3.4729]
["CdIn2S4","mp-559200",252372,0.9323,0.9328,1.2033,1.2027,1.0815,1.9327,1.9454,1.4718,2.4386,1.6561,2.2522,2.5834,2.6055,2.8818,2.8195,2.44,"10.1143/JJAP.19.103"]
["CdIn2Se4","mp-568032",151953,0.7914,0.674,1.0129,0.8945,0.9104,1.8353,1.711,1.2525,1.8766,1.3274,1.873,2.0862,2.1091,2.4251,2.2611,1.55]
["CdIn2Se4","mp-22304",151954,0.7542,0.6242,0.9841,0.8547,0.8749,1.8888,1.7511,1.2496,1.8791,1.3081,1.8293,2.0479,2.053,2.4172,2.2543,1.46,"10.1088/0953-8984/2/28/003"]
["CdP4","mp-7904",25605,0.2349,0.2343,0.3312,0.324,0.2495,1.0888,1.1044,0.4487,0.6939,0.5188,0.9183,0.9098,1.002,1.5313,1.1319,1.15]
["CdS","mp-672",154186,0.9595,0.9444,1.2382,1.2237,1.0978,2.7441,2.7187,1.65,2.6324,1.5918,2.2922,2.5945,2.7283,2.9064,3.0772,2.482]
["CdSb","mp-1321",52830,0.1212,0.098,0.2127,0.1872,0.1688,0.5698,0.5418,0.3115,0.5885,0.2188,0.7056,0.774,0.7611,1.2715,0.858,0.459]
["CdSb2Se3Br2","mp-567556",159464,0.9783,0.9263,1.0817,1.0279,1.0147,1.5154,1.4497,1.2718,1.5222,1.2355,1.689,1.7474,1.8297,2.2876,2.0491,1.4,"10.1021/cm701995d"]
["CdSe","mp-2691",187310,0.4646,0.3423,0.7493,0.6308,0.6162,2.1115,1.9696,1.1162,1.9986,1.071,1.7206,2.0384,2.0453,2.3249,2.3368,1.74]
["CdSe","mp-1070",415785,0.4813,0.3597,0.7668,0.6488,0.6371,2.0827,1.9411,1.128,2.0196,1.0953,1.735,2.0546,2.0621,2.32,2.3311,1.732]
["CdSiAs2","mp-3078",22187,0.6612,0.612,0.8611,0.8129,0.7982,1.0603,1.0033,1.0616,1.6693,1.1945,1.6877,1.8166,1.8186,1.8961,1.8503,1.55]
["CdSiP2","mp-4666",23696,1.2179,1.2152,1.3453,1.3419,1.2302,2.408,2.4046,1.5883,1.9645,1.5799,1.98,2.0023,2.0697,2.1933,1.9271,2.085]
["CdSnAs2","mp-3829",44258,0.109,0.0759,0.1064,0.0742,0.1074,0.1382,0.0576,0.0989,0.5081,0.101,0.4349,0.6631,0.6027,0.9611,0.728,0.26]
["CdSnO3","mp-754329",181930,1.0345,1.0337,1.1733,1.1682,1.0723,2.1407,2.1704,1.8477,2.9323,1.6121,2.712,3.5088,4.0859,3.4141,4.8137,3.1,"10.1021/cm049249w"]
["CdSnP2","mp-5213",44257,0.3688,0.3613,0.5777,0.5686,0.49,1.1193,1.1112,0.7726,1.404,0.8326,1.3881,1.5709,1.5902,1.9642,1.7211,1.2343]
["CdTe","mp-406",161693,0.5501,0.2732,0.7906,0.5208,0.6805,1.7117,1.3965,1.0571,1.7669,1.0377,1.6506,1.8908,1.8665,2.2386,2.0641,1.475]
["CrSi2","mp-1222",161434,0.3877,0.3836,0.4452,0.4238,0.4195,0.3033,0.3339,0.5957,0.6337,0.7351,1.4963,1.8784,1.1611,2.1083,0.0732,0.35,"10.1063/1.340078"]
["Cs2AgBiBr6","mp-1078250",291597,1.2486,1.1062,1.421,1.2658,1.3262,2.4995,2.0713,1.7913,2.2981,1.5618,2.3212,2.6135,2.7145,2.915,3.0564,2.19,"10.1021/acs.chemmater.5b04231"]
["Cs2AgBiCl6","mp-1078258",291598,1.7366,1.5276,1.9409,1.7083,1.8263,3.1908,2.5182,2.2581,2.9097,2.1771,3.0095,3.3609,3.6111,3.6381,4.0776,2.77,"10.1021/acs.chemmater.5b04231"]
["Cs2AgVS4","mp-8684",50460,1.317,1.3151,1.3896,1.383,1.3577,1.312,1.3091,1.4265,1.7187,1.6085,2.4087,2.5922,2.8282,3.025,3.1154,1.77,"10.1002/(SICI)1521-3749(199808)624:8<1285::AID-ZAAC1285>3.0.CO;2-5"]
["Cs2Au2Br6","mp-569548",170696,0.8863,0.8404,0.8848,0.8306,0.8854,0.7133,0.6963,0.8689,0.8056,1.0273,1.3877,1.4424,1.6593,1.962,2.0808,1.6,"10.1103/PhysRevB.59.7925"]
["Cs2Au2Cl6","mp-23484",6061,1.0879,1.0046,1.0757,0.9821,1.0858,0.7778,0.731,1.029,0.8964,1.2332,1.7136,1.8276,2.1697,2.3133,2.694,2.04,"10.1103/PhysRevB.59.7925"]
["Cs2Au2I6","mp-28453",59269,0.7777,0.6716,0.8164,0.7052,0.8087,0.6924,0.5936,0.8112,0.7682,0.9496,1.2059,1.2038,1.3365,1.7614,1.6398,1.31,"10.1103/PhysRevB.59.7925"]
["Cs2Cd3Te4","mp-567386",90369,1.5361,1.3013,1.7635,1.5349,1.6464,2.7279,2.5072,2.056,2.645,2.0833,2.554,2.6985,2.7029,2.8533,2.6412,2.48,"10.1021/ic001346d"]
["Cs2Hg3I8","mp-540574",4074,1.706,1.4194,1.8894,1.6073,1.8098,2.5708,2.2388,2.1157,2.6345,2.0542,2.8108,3.0122,3.1073,3.3358,3.4002,2.56,"10.1021/cg800054x"]
["Cs2SnBr6","mp-641923",158957,0.9992,0.9154,1.2207,1.127,1.1398,1.6735,1.577,1.4507,2.1877,1.4859,2.2703,2.5153,2.7078,2.9569,3.0636,2.7,"10.1021/acs.jpcc.6b02175"]
["Cs2SnCl6","mp-608555",9023,2.7062,2.6843,2.9652,2.9353,2.8851,3.3712,3.3481,3.19,4.2445,3.3761,4.3276,4.7461,5.1172,4.7246,5.6172,3.9,"10.1021/acs.jpcc.6b02175"]
["Cs2TeBr6","mp-23405",65058,1.8691,1.7894,1.9714,1.8949,1.9252,2.4041,2.2318,2.1657,2.4367,2.0918,2.5911,2.6274,2.8381,3.2021,3.2482,2.2,"10.1134/S0020168511010109"]
["Cs2TeI6","mp-540957",38105,1.2108,0.9828,1.3397,1.1089,1.2742,1.7154,1.4508,1.5491,1.6927,1.4937,1.854,1.8357,1.9609,2.4233,2.2291,1.52,"10.1134/S0020168511010109"]
["Cs2TiAg2S4","mp-10488",280645,1.4655,1.4622,1.5621,1.5573,1.506,1.837,1.8337,1.6588,1.9342,1.7618,2.3893,2.5317,2.6915,3.0356,3.0243,2.44,"10.1021/ic001346d"]
["Cs3Bi2Br9","mp-27544",1142,2.3974,1.817,2.545,1.9283,2.4718,3.094,2.06,2.7526,3.1749,2.6868,3.2747,3.3579,3.5866,3.8108,3.9234,2.5,"10.1134/S0020168511010109"]
["Cs3Bi2I9","mp-624214",23124,1.9755,1.6221,2.0952,1.7353,2.0303,2.6291,1.8358,2.2889,2.576,2.2005,2.7092,2.7135,2.8586,3.3284,3.1479,1.8,"10.1134/S0020168511010109"]
["Cs3Sb","mp-10378",53243,0.6122,0.4957,0.842,0.728,0.7373,1.6412,1.5124,1.145,1.6314,1.2032,1.4121,1.41,1.4371,1.8921,1.437,1.6]
["Cs3Sb2Br9","mp-579560",39824,1.5208,1.4186,1.6027,1.5006,1.5484,2.0707,1.7612,1.8184,2.0642,1.7434,2.1795,2.2202,2.4125,2.7194,2.7728,2.3,"10.1134/S0020168511010109"]
["Cs3Sb2I9","mp-23029",84989,1.5378,1.424,1.6134,1.5073,1.5594,2.1845,2.0107,1.8408,2.0278,1.7775,2.1488,2.1287,2.2696,2.7656,2.5632,1.89,"10.1134/S0020168511010109"]
["CsAu","mp-2667",58427,0.8322,0.81,0.9043,0.8807,0.8244,1.7808,1.7337,1.1504,1.1423,1.5391,1.044,0.6972,1.0279,1.6085,1.5494,2.5]
["CsLaHgSe3","mp-11124",281441,1.3651,1.2621,1.5678,1.4628,1.4688,1.2799,1.0484,1.8409,2.3937,1.7472,2.4059,2.5921,2.605,2.8076,2.6386,2.46,"10.1021/ic020733f"]
["CsPbBr3","mp-567629",97851,1.6495,0.6648,1.8012,0.8136,1.6986,3.0228,1.7127,2.1734,2.5816,2.1247,2.42,2.4103,2.6772,3.046,3.2024,2.32,"10.1021/acs.jpclett.5b00968"]
["CsSnBr3","mp-27214",4071,0.2963,0.0484,0.3586,0.0239,0.2776,1.4208,0.9917,0.6964,0.8603,0.5739,0.7546,0.6866,0.9197,1.2973,1.3901,1.75,"10.1039/c5ra22317b"]
["CsSnCl3","mp-27394",14199,2.7261,2.6733,2.8522,2.8025,2.7583,3.9339,3.7876,3.075,3.3928,3.1935,3.6231,3.6123,4.0186,4.1846,4.5097,2.8,"10.1039/c5ra22317b"]
["CsSnI3","mp-568570",69996,0.4832,0.1819,0.505,0.2204,0.4542,1.2263,0.8473,0.8361,0.8644,0.6041,0.8412,0.7442,0.928,1.4134,1.3023,1.31,"10.1039/c5ra22317b"]
["CsYCdSe3","mp-11116",281433,1.9754,1.866,2.2203,2.1113,2.0956,2.9661,2.8401,2.5378,3.0209,2.6611,3.1563,3.2839,3.3687,3.7281,3.4787,2.48,"10.1021/ic020733f"]
["CsYHgSe3","mp-11123",281440,1.3336,1.2408,1.5331,1.4396,1.4307,2.377,2.2603,1.7837,2.3349,1.7627,2.4269,2.6455,2.6408,3.0119,2.7585,2.54,"10.1021/ic020733f"]
["CsYZnSe3","mp-574620",280847,1.968,1.8706,2.1561,2.06,2.0582,2.9134,2.7999,2.4547,2.9165,2.5963,3.0777,3.2109,3.2952,3.6702,3.4291,2.29,"10.1021/ic011200u"]
["Cu2CdGeS4","mp-13982",26150,0.5212,0.5162,0.6555,0.6438,0.5861,1.6729,1.6631,1.0955,1.3393,0.8874,1.9127,2.4738,2.4314,2.5659,2.6434,2.05,"10.1016/S0925-8388(01)01987-9"]
["Cu2CdGeSe4","mp-10967",95235,0,0.0003,0,0.0031,0,0.7647,0.7004,0.3166,0.5984,0.108,0.9973,1.4846,1.3567,1.5723,1.5143,1.2,"10.1016/S0022-0248(99)00468-6"]
["Cu2GeS3","mp-15252",85138,0.238,0.2341,0.3127,0.3004,0.2789,0.8556,0.8483,0.648,0.7767,0.4589,1.4112,1.9268,1.8978,1.9736,2.0753,1.53,"10.1002/pssc.201600199"]
["Cu2GeSe3","mp-4728",160386,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0.818,"10.1002/pssb.201700332"]
["Cu2GeSe3","mp-677105",192171,0,0,0.0135,0,0,0.1925,0.1767,0.122,0.1516,0.0737,0.4524,0.7536,0.6966,0.8502,0.781,0.78,"10.7567/JJAP.53.05FW06"]
["Cu2O","mp-361",172174,0.532,0.4472,0.5285,0.4229,0.4917,0.756,0.672,0.7625,0.7726,0.7729,2.0179,2.6314,3.0611,2.6593,3.5065,2.17]
["Cu2S","mp-618991",16550,0.0457,0.0284,0.106,0.0803,0.0613,1.0672,1.0431,0.5541,0.7474,0.378,1.2545,1.7585,1.7128,1.8735,1.8662,1.04,"10.1103/PhysRevB.96.054108"]
["Cu2S","mp-553942",20560,0,0,0,0,0,0.0965,0.0351,0,0,0.0563,0,0.3895,0.1946,0.0059,0.0174,1.21]
["Cu2Se","mp-16366",56025,0,0,0,0,0,0.3355,0.2608,0.0001,0.0001,0,0,0.7141,0.43,0.6761,0.5848,1.2]
["Cu2SnS3","mp-10519",91762,0.1187,0.1148,0.1351,0.1293,0.1244,0.4897,0.488,0.0944,0.349,0.2099,0.8912,1.3338,1.311,1.4486,1.4865,0.86,"10.1002/pssc.201600199"]
["Cu2SnSe3","mp-11658",97966,0.0863,0.0968,0.0862,0.0946,0.0862,0.1031,0.1044,0.0831,0.0847,0.0912,0.3435,0.7578,0.6419,0.8284,0.7203,0.843,"10.1063/1.1383984"]
["Cu2Te","mp-1861",77055,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0.9,"10.1016/j.tsf.2011.04.027"]
["Cu2ZnGeSe4","mp-10824",93409,0,0.0748,0,0.0694,0,0.6532,0.5923,0.2811,0.5482,0.0654,0.9732,1.4354,1.3402,1.5906,1.5315,1.29,"10.1016/0025-5408(77)90150-7"]
["Cu2ZnSiS4","mp-977414",261367,1.1863,1.183,1.2952,1.2876,1.2296,2.3222,2.3163,1.7379,1.9258,1.5981,2.581,3.0924,3.0302,3.2481,3.1899,2.97,"10.1063/1.3490219"]
["Cu2ZnSnS4","mp-1025500",184478,0.3614,0.3441,0.4889,0.4631,0.4144,1.5156,1.4942,0.9723,1.1632,0.7568,1.7464,2.3008,2.2472,2.392,2.4774,1.51,"10.1016/S1001-0521(07)60096-5"]
["Cu3AsS4","mp-3345",413350,0.1734,0.1701,0.2532,0.238,0.2208,0.6365,0.6304,0.5479,0.6454,0.3846,1.3577,1.8159,1.8003,1.9936,1.9748,1.24]
["Cu3AsSe4","mp-675626",610361,0,0,0,0,0,0,0,0,0,0,0.3545,0.7353,0.6461,0.7817,0.6365,0.88]
["Cu3PS4","mp-3934",412240,1.1608,1.1584,1.2465,1.2322,1.1983,1.8497,1.8522,1.6381,1.6345,1.562,2.5238,2.9167,2.9487,3.102,3.0606,2.35]
["Cu3PSe4","mp-5756",95412,0.1783,0.1469,0.2874,0.2537,0.241,0.8584,0.813,0.6484,0.8246,0.5408,1.3545,1.7145,1.684,1.9815,1.7931,1.4,"10.1063/1.3656760"]
["Cu3SbS4","mp-5702",412239,0,0.025,0,0.043,0,0.308,0.2803,0.1631,0.2338,0.0001,0.8774,1.3623,1.2948,1.5173,1.4943,0.88,"10.1002/aenm.201200538"]
["Cu3SbSe4","mp-9814",400652,0,0,0,0,0,0,0,0,0,0,0.2789,0.6922,0.5669,0.7189,0.5945,0.29,"10.1039/C4TA01957A"]
["CuAlO2","mp-3748",60844,1.9635,1.9577,1.9311,1.9204,1.9079,2.4866,2.4844,2.1749,1.9805,2.1961,3.4878,4.1766,4.7267,4.1964,5.2703,2.99,"10.1063/1.2200398"]
["CuAlS2","mp-4979",42124,1.787,1.7774,1.8931,1.8802,1.8127,3.1858,3.1736,2.4054,2.4729,2.3597,3.2751,3.7013,3.6113,3.6193,3.7907,3.45,"10.1016/j.optcom.2007.11.031"]
["CuAlSe2","mp-8016",28734,0.9955,0.9707,1.1537,1.1316,1.0721,2.2433,2.2101,1.6073,1.8762,1.538,2.4293,2.9965,2.713,2.8755,2.6497,2.68]
["CuBiP2Se6","mp-569715",195341,0.7234,0.5446,0.8243,0.6244,0.7731,1.3213,0.9889,1.0006,1.1241,1.021,1.8731,2.1638,2.0743,2.4317,2.0079,1.2,"10.1021/ic050357%2B"]
["CuBr","mp-22913",78274,0.2944,0.2576,0.4787,0.4468,0.3645,2.8695,2.8243,1.2934,1.4723,0.743,2.175,3.1132,3.0182,2.7947,3.3187,3.0726]
["CuBS2","mp-12954",156413,1.6081,1.6049,1.6828,1.6759,1.5995,2.9066,2.9025,1.9609,2.06,1.9159,2.7299,3.0606,3.0026,3.0143,3.162,3.61,"10.1016/j.matlet.2006.09.018"]
["CuCl","mp-22914",78270,0.3877,0.3247,0.5351,0.4676,0.4219,3.0999,3.033,1.4217,1.5355,0.8146,2.3529,3.37,3.5391,2.9359,3.9738,3.399]
["CuGaO2","mp-4280",60846,0.9641,0.9594,0.9457,0.938,0.9175,1.5937,1.5901,1.1936,1.0711,1.1963,2.4138,3.123,3.8303,3.1094,4.4961,2.55,"10.1021/jp2087225"]
["CuGaS2","mp-5238",66864,0.7729,0.7675,0.8927,0.881,0.8289,1.9238,1.9159,1.42,1.6317,1.227,2.2121,2.824,2.7497,2.8476,2.9561,2.51]
["CuGaSe2","mp-4840",42097,0.0519,0.0118,0.2107,0.1724,0.1441,1.0868,1.0398,0.6352,0.9613,0.451,1.3525,1.9012,1.7326,1.9425,1.8686,1.695]
["CuGaTe2","mp-3839",74456,0.4515,0.2638,0.5947,0.4147,0.5368,1.2249,1.0054,0.9316,1.2841,0.7592,1.6358,2.0602,1.8853,2.2077,1.929,1.227]
["CuI","mp-22895",33724,1.0071,0.8345,1.1764,1.0155,1.0654,3.1398,2.9245,1.8609,2.1163,1.4897,2.6376,3.3335,3.0836,3.2784,3.214,3.118]
["CuInS2","mp-22736",186714,0.1955,0.1822,0.3222,0.3015,0.2446,1.5481,1.5309,0.8304,0.9757,0.603,1.6119,2.1918,2.1142,2.1832,2.2588,1.53]
["CuInSe2","mp-22811",252780,0.031,0.0194,0.0321,0.0209,0.032,0.8796,0.8253,0.2666,0.5119,0.0595,0.9516,1.463,1.3037,1.5428,1.4451,1.0386]
["CuInTe2","mp-22261",74460,0,0.0203,0.1287,0.0212,0.0609,0.78,0.5462,0.3929,0.7069,0.2464,1.0094,1.3466,1.2138,1.5842,1.3091,1.057,"10.1016/j.matchemphys.2014.05.012"]
["CuLaO2","mp-20072",18102,2.4819,2.5223,2.5317,2.455,2.4653,1.8829,1.7276,3.0319,2.6242,2.8299,3.8653,4.1885,4.5208,4.4532,5.0144,2.34,"10.1016/j.ijhydene.2005.08.015"]
["CuSbSe2","mp-20331",418754,0.5305,0.464,0.5861,0.5212,0.5451,1.1111,0.9743,0.7767,0.81,0.6882,1.3037,1.5258,1.4432,1.9219,1.4693,1.04]
["CuScO2","mp-4636",55689,2.4246,2.4075,2.4214,2.3996,2.3839,3.0968,3.1059,2.6225,2.4297,2.6667,3.9381,4.586,5.1118,4.6449,5.7476,3.3,"10.1016/S1466-6049(01)00006-X"]
["CuTaN2","mp-8927",71136,0.8705,0.7577,0.9631,0.8403,0.8851,1.1776,1.0078,1.3117,1.5631,1.2481,2.0516,2.4845,2.554,2.7085,2.8813,1.5,"10.1039/C3EE40621K"]
["FeP2","mp-20027",15027,0.3064,0.3024,0.3864,0.3399,0.3384,0.2006,0.1372,0.6643,0.9026,0.8329,1.8228,2.4847,1.8231,2.2775,1.1165,0.37,"10.1088/0031-8949/4/3/010"]
["FeS2","mp-226",109377,0.5864,0.5778,0.6432,0.5981,0.5974,0.7947,0.7395,0.9964,1.3026,1.1537,2.2161,3.0647,2.5734,3.0425,2.3256,0.95,"10.1016/S0927-0248(01)00053-8"]
["Ga2S3","mp-539",409550,1.6933,1.6917,1.9212,1.9069,1.8222,2.4921,2.4907,2.2595,2.9723,2.3499,3.0563,3.358,3.4687,3.6298,3.6478,3.44,"10.1063/1.1609254"]
["GaAs","mp-2534",107946,0.3338,0.2225,0.5676,0.4572,0.5012,0.8615,0.7412,0.7595,1.5485,0.8031,1.4624,1.7915,1.6867,2.0736,1.8455,1.51914]
["GaN","mp-804",157398,1.8714,1.8681,1.8661,1.8625,1.8188,2.7632,2.7568,2.5766,3.1633,2.2321,3.1466,3.6284,4.0353,3.8282,4.6283,3.503]
["GaP","mp-2490",77087,1.4911,1.462,1.6436,1.6139,1.5121,2.3918,2.3625,1.8354,2.3194,1.8833,2.3006,2.3098,2.4536,2.9342,2.7437,2.35]
["GaS","mp-2507",173940,1.411,1.4095,1.5921,1.5826,1.4755,2.3656,2.3638,1.8084,2.2425,1.8521,2.3267,2.3319,2.5811,2.9783,2.9671,2.54,"10.1063/1.2358192"]
["GaSb","mp-1156",635318,0,0,0.1636,0,0.1165,0.1817,0,0.2481,0.8829,0.1604,0.9615,1.1311,1.1295,1.5532,1.2222,0.822]
["GaSe","mp-1943",63122,0.7037,0.6794,0.9449,0.9163,0.8463,1.6381,1.6112,1.1984,1.8903,1.3012,1.847,1.9043,2.0786,2.4642,2.3179,2.103]
["GaTe","mp-542812",8249,0.7921,0.7322,0.9465,0.8826,0.8715,1.4658,1.4031,1.1262,1.4618,1.1525,1.6191,1.6985,1.745,2.186,1.8977,1.799]
["Ge","mp-32",184252,0,0,0.1097,0.0141,0.0686,0.1499,0.0525,0.1868,0.8173,0.1389,0.863,0.9817,1.0919,1.4781,1.4793,0.744]
["GeAs","mp-9548",86361,0.3901,0.3875,0.4927,0.4826,0.4396,0.838,0.8656,0.5785,0.8384,0.6102,0.9622,1.0314,1.0575,1.4144,1.2108,0.65,"10.1103/PhysRevB.3.2581"]
["GeAs2","mp-17524",23872,0.4719,0.4674,0.5852,0.5754,0.5189,0.9955,0.9887,0.7267,1.0015,0.7832,1.1426,1.1973,1.2274,1.694,1.3326,1.06,"10.1103/PhysRevB.3.2581"]
["GeO2","mp-470",92551,1.7729,1.7735,1.8847,1.8696,1.8332,1.9912,1.9914,2.6558,3.9932,2.4683,3.8637,4.9897,6.0532,4.5883,6.7994,5.35]
["GeSe","mp-700",41738,0.5885,0.565,0.6439,0.6206,0.5882,1.2552,1.1989,0.9177,1.0094,0.777,1.1342,1.121,1.2117,1.7193,1.3709,1.075]
["HfNBr","mp-568346",95720,1.9549,1.9368,2.0859,2.0636,2.0027,2.1885,2.1624,2.332,3.1502,2.4344,3.2109,3.5777,3.717,3.911,4.0414,3.1,"10.1021/ic401548a"]
["HfO2","mp-352",173158,3.8627,3.837,4.0349,4.006,3.9404,4.1375,4.1037,4.4844,5.6938,4.445,5.6162,6.2414,6.8973,6.3287,7.4767,5.5,"10.1016/j.tsf.2004.01.110"]
["HfS2","mp-985829",601164,0.8427,0.8049,0.9982,0.9597,0.9094,1.3071,1.2994,1.054,1.6361,1.2721,1.8134,1.9277,2.0072,2.3659,2.069,1.96,"10.1016/0022-3697(65)90043-0"]
["HfSe2","mp-985831",195308,0.3544,0.1719,0.4676,0.2873,0.3982,0.8297,0.6778,0.6666,1.0607,0.746,1.1594,1.2436,1.2648,1.7561,1.3248,1.13,"10.1016/0022-3697(65)90043-0"]
["Hg2I2","mp-22859",262368,1.5442,1.4468,1.6659,1.5813,1.6104,2.0378,1.9272,1.7744,2.0873,1.8622,2.481,2.5984,2.7092,3.0388,2.8767,3,"10.1201/9781420050196"]
["Hg4As2CdI4","mp-570838",416973,0.6379,0.4916,0.8416,0.6863,0.7711,1.1146,0.9075,1.0241,1.7452,0.8375,1.7683,2.0622,2.0365,2.0049,1.8063,1.45,"10.1016/j.jssc.2006.11.018"]
["HgGa2S4","mp-4809",67220,1.5612,1.542,1.7764,1.7516,1.6707,2.6836,2.6608,2.0378,2.7581,2.0507,2.8061,3.1025,3.1902,3.204,3.446,2.79]
["HgGa2Se4","mp-4730",83712,0.9186,0.7889,1.13,1.0006,1.0347,1.9474,1.8028,1.3723,2.0056,1.3695,2.0233,2.2967,2.2827,2.6243,2.4851,1.99]
["HgI2","mp-23192",181575,1.0047,0.7181,1.1999,0.9117,1.1127,1.9589,1.6508,1.4431,1.9937,1.3398,2.1147,2.3228,2.3876,2.7184,2.5648,2.397]
["HgIn2Se4","mp-20731",25649,0.4628,0.3414,0.6815,0.5608,0.5783,1.5896,1.453,0.9255,1.521,0.9237,1.5003,1.7216,1.7234,2.0884,1.9339,1.16]
["HgIn2Te4","mp-19765",25652,0.589,0.3101,0.7649,0.4903,0.6761,1.4058,1.0959,0.9353,1.3922,0.8735,1.486,1.6427,1.6248,2.0645,1.7541,0.9]
["HgO","mp-1224",14124,1.1805,1.1558,1.239,1.1967,1.2048,1.3076,1.2906,1.5159,1.7961,1.4734,2.3374,2.6258,3.0353,3.016,3.5848,1.9,"10.1103/PhysRevB.71.235109"]
["HgS","mp-634",81923,1.382,1.3518,1.5492,1.5057,1.4628,2.2241,2.2052,1.7262,2.2861,1.7312,2.5463,2.7804,2.8883,3.1717,3.1116,2.03]
["HgS","mp-1123",81917,0,0.1107,0,0.1149,0,0.8308,0.8153,0,0.6779,0,0.4989,0.7995,0.8914,1.1089,1.2342,0.54]
["HgSnO3","mp-13554",260029,0,0.1286,0.031,0.0825,0,0.7465,0.6984,0.6424,1.5454,0.3675,1.546,2.3612,2.7605,2.1205,3.2761,1.6,"10.1021/ic800370r"]
["In2Se3","mp-19907",5419,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1.356,"10.1002/pssa.2211180228"]
["In2Se3","mp-20830",640498,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,1.308,"10.1002/pssa.2211180228"]
["In6S7","mp-555853",15317,0.2342,0.2349,0.3281,0.3255,0.2666,0.9057,0.9065,0.3802,0.6256,0.5217,0.8644,0.84,1.0089,1.4348,1.2615,0.93,"10.1063/1.3698334"]
["In6Se7","mp-567596",9135,0.0538,0.0611,0.0503,0.0496,0.0416,0.6448,0.6368,0.0544,0.3243,0.2295,0.4771,0.4507,0.5599,1.0085,0.7517,2.2,"10.1142/S0218625X13500583"]
["InAs","mp-20305",41444,0,0,0,0,0,0.225,0.1011,0,0.643,0.0084,0.5475,0.7715,0.7104,1.1235,0.8726,0.41675,"10.1063/1.363660"]
["InBi2S4Cl","mp-559521",484,1.4452,1.3264,1.6184,1.4741,1.5204,2.139,1.8499,1.7624,2.2644,1.8288,2.3594,2.4536,2.5482,2.9979,2.5225,1.5,"10.1021/cm701995d"]
["InBi2Se4Br","mp-571169",159465,1.1498,0.8904,1.2836,0.9966,1.2116,1.6743,1.1328,1.4203,1.7816,1.4007,1.9178,1.9975,2.0526,2.4914,2.2139,1.21,"10.1021/cm701995d"]
["InN","mp-22205",109463,0,0.0027,0,0.003,0,0.6812,0.6784,0.2631,0.8946,0.023,0.7416,1.0741,1.2708,1.353,1.7179,0.695,"10.1103/PhysRevB.77.245207"]
["InP","mp-20351",41443,0.483,0.4523,0.7064,0.677,0.6085,1.3475,1.3144,0.9086,1.5975,1.0474,1.5168,1.6822,1.7058,2.1381,1.88,1.4236]
["InPS4","mp-20790",1699,2.2578,2.2588,2.4875,2.4765,2.3815,3.0267,2.9825,2.6962,3.3058,2.881,3.5875,3.8419,3.9335,4.0144,4.1138,3.12,"10.1021/acs.cgd.7b00214"]
["InS","mp-19795",81338,1.0318,1.0332,1.1878,1.1856,1.1094,1.7127,1.7322,1.3339,1.8237,1.4522,1.9588,2.0923,2.1488,2.5724,2.3239,2.09,"10.1016/j.optmat.2013.10.046"]
["InSb","mp-20012",162196,0,0,0,0,0,0,0,0,0.4449,0,0.5382,0.7417,0.6684,0.9706,0.6596,0.2352]
["InSb2S4Br","mp-559864",159467,1.3722,1.3367,1.4907,1.4499,1.4108,1.9768,1.8978,1.6447,1.9796,1.664,2.1702,2.2462,2.3369,2.7589,2.5073,1.5,"10.1021/cm701995d"]
["InSb2S4Cl","mp-556541",159468,1.4139,1.3771,1.5311,1.4893,1.4519,2.0081,1.9262,1.6767,2.0187,1.6994,2.2057,2.2803,2.3919,2.8212,2.5934,1.8,"10.1021/cm701995d"]
["InSb2Se4Br","mp-570321",159466,0.9458,0.895,1.0462,0.9916,0.9852,1.5004,1.3913,1.2182,1.4776,1.178,1.6138,1.6881,1.7199,2.1519,1.8409,1.21,"10.1021/cm701995d"]
["InTe","mp-20320",169418,0,0,0,0,0,0.2949,0.2698,0,0.0572,0,0.1574,0.0473,0.1617,0.7242,0.2663,1.16]
["K2AgVS4","mp-8900",66840,1.2084,1.2075,1.2996,1.2962,1.2601,1.3151,1.3122,1.3575,1.7039,1.5376,2.3223,2.5251,2.8171,2.9562,3.1553,1.85,"10.1002/(SICI)1521-3749(199808)624:8<1285::AID-ZAAC1285>3.0.CO;2-5"]
["K2Au2SnS4","mp-557121",74022,1.6269,1.5718,1.8368,1.7676,1.7479,2.4992,2.4445,2.0889,2.7496,2.1333,2.8447,3.0525,3.2606,3.3187,3.5675,2.75,"10.1021/cm00034a029"]
["K2AuPS4","mp-9509",85679,1.1856,1.1443,1.3871,1.3343,1.2823,2.4263,2.3771,1.6658,2.3294,1.6639,2.3545,2.5135,2.7362,2.9757,3.0843,2.63,"10.1002/(SICI)1099-0682(199802)1998:2<283::AID-EJIC283>3.0.CO;2-L"]
["K2CsSb","mp-581024",53237,0.8425,0.679,1.0655,0.9076,0.9746,1.822,1.6394,1.4254,2.0665,1.5159,1.6552,1.6648,1.6953,2.0663,1.6414,1]
["K2Hg3Ge2S8","mp-11131",281506,1.3872,1.3827,1.5647,1.5503,1.4918,2.2551,2.2308,1.726,2.322,1.7357,2.504,2.7075,2.9097,3.1569,3.2869,2.7,"10.1021/ja034121l"]
["K2La2Ti3O10","mp-6548",74193,2.0009,1.9993,2.1024,2.0992,2.0493,1.3628,1.241,2.2636,2.9714,2.4526,3.5202,4.17,4.7792,4.21,5.4721,3.05,"10.1016/j.jssc.2004.12.024"]
["K2PbGe2S6","mp-561132",170601,2.1378,2.0796,2.2819,2.2178,2.2236,2.7109,2.6778,2.4239,2.9414,2.5234,3.2067,3.3103,3.5882,3.7517,3.8784,2.85,"10.1021/ic050087v"]
["K2TeBr6","mp-22963",22078,2.0969,1.9705,2.1882,2.0627,2.1473,2.5296,2.3095,2.3498,2.6343,2.3125,2.8251,2.8625,3.1279,3.1881,3.3195,2.17,"10.1134/S0020168511010109"]
["K2TeI6","mp-27688",23649,1.6695,1.3959,1.7309,1.4736,1.7025,1.9059,1.5826,1.8417,1.9891,1.8427,2.228,2.2161,2.3615,2.839,2.432,1.38,"10.1134/S0020168511010109"]
["K2ZnTe2","mp-12535",420088,1.9426,1.7007,2.1311,1.896,2.0758,3.0368,2.7968,2.51,3.0028,2.3465,2.9209,3.0202,3.1022,3.3211,3.1084,3,"10.1016/j.jssc.2009.02.020"]
["K3Sb","mp-10159",44677,0.573,0.4303,0.768,0.6296,0.7062,1.5137,1.345,1.1402,1.7408,1.211,1.3018,1.3043,1.3399,1.4906,1.2163,1.4]
["K3Sb","mp-14017",656327,0.3426,0.2319,0.4737,0.3612,0.4325,1.5167,1.3666,0.8416,1.4707,0.7841,0.9845,0.9642,0.999,1.5144,1.0929,1.1]
["K6CdTe4","mp-17698",420087,1.4688,1.2903,1.6826,1.5084,1.6174,2.817,2.5986,2.1487,2.9401,1.9523,2.3797,2.4469,2.5289,2.8436,2.6968,2.51,"10.1016/j.jssc.2009.02.020"]
["KAg2PS4","mp-12532",420033,0.9179,0.9155,1.1411,1.1326,1.0261,2.4921,2.4882,1.5338,2.2901,1.525,2.3041,2.6657,2.7352,2.9584,2.9931,3.02,"10.1016/j.jssc.2008.11.017"]
["KAg2SbS4","mp-9490",82143,0.1247,0.1237,0.3151,0.3038,0.223,1.1776,1.1768,0.6375,1.1699,0.5634,1.3735,1.7253,1.7718,2.0112,2.0111,1.71,"10.1016/j.jallcom.2018.02.331"]
["KBiSiS4","mp-866651",421485,2.0422,1.7309,2.1931,1.8608,2.1122,2.5846,1.9568,2.3018,2.7564,2.3297,2.9607,3.0187,3.2075,3.4915,3.406,2.25,"10.1016/j.jssc.2010.05.003"]
["KBr","mp-23251",187220,3.955,3.7903,4.3567,4.1968,4.2108,6.5809,6.404,4.9788,6.4563,4.9103,5.5134,5.778,6.1149,6.225,6.6843,7.8,"10.1103/PhysRevLett.19.496"]
["KCl","mp-23193",165593,4.7653,4.7221,5.2078,5.1658,5.0421,7.5811,7.5364,5.8889,7.7775,5.7846,6.518,6.8715,7.4373,6.8187,8.1893,8.69,"10.1103/PhysRev.166.599"]
["KCu3S2","mp-9868",100001,0.3064,0.3049,0.4387,0.4321,0.3695,1.678,1.6712,0.92,1.2061,0.6957,1.5554,1.9722,2.0193,2.1382,2.234,1.64,"10.1039/C4RA12541J"]
["KCu4AsS4","mp-557728",420017,1.3951,1.3824,1.4436,1.4217,1.4033,2.1534,2.1401,1.731,1.6492,1.5794,2.4533,2.7694,2.8552,3.0138,3.0543,1.9,"10.1016/j.jssc.2012.08.039"]
["KCuThS3","mp-12365",170864,2.0178,2.0009,2.1039,2.0816,2.0306,1.8202,1.608,2.2845,2.3959,2.2941,3.0449,3.2105,3.3445,3.4709,3.4902,2.95,"10.1021/ic050561x"]
["Kr","mp-612118",43726,6.7688,6.5297,7.2706,7.0383,7.14,10.0967,9.8183,8.0257,10.6397,8.0351,8.6663,9.081,9.6365,9.4153,10.3834,11.59,"10.1016/0030-4018(86)90186-0"]
["KTaO3","mp-3614",280424,2.0201,1.8543,2.1664,1.9959,2.0754,2.1052,1.8915,2.4971,3.5942,2.5294,3.5312,4.0947,4.8717,4.1915,5.4838,3.64,"10.1103/PhysRevB.74.155130"]
["La2O3","mp-1968",56771,3.7694,3.7445,3.8637,3.8427,3.8091,2.2016,2.1106,4.1564,4.672,4.264,5.3399,5.8116,6.1671,5.8682,6.3108,5.34,"10.1143/JPSJ.69.3451"]
["LaCuOS","mp-6088",96343,1.5962,1.5907,1.6807,1.6738,1.6283,0.7565,0.6068,1.839,2.0054,2.0068,2.9629,3.4404,3.3902,3.6397,3.5616,3.1,"10.1063/1.1364656,10.1063/1.1319507"]
["LaCuOSe","mp-552488",96758,1.4385,1.4071,1.5504,1.4831,1.4855,0.6287,0.256,1.7562,1.8636,1.9027,2.7538,3.2215,3.0869,3.4019,3.2067,2.8,"10.1063/1.1456240"]
["LaCuOTe","mp-546790",416522,1.125,0.9284,1.1858,0.9991,1.1506,0.3873,0.0895,1.3895,1.5438,1.4819,2.2108,2.516,2.4207,2.8392,2.5087,2.31,"10.1016/j.jssc.2006.09.014"]
["LaF3","mp-905",252346,6.1348,5.9892,6.1329,5.9897,6.2167,2.8013,2.4959,6.063,6.2495,7.2838,9.6849,11.8329,12.3768,10.1997,13.0525,10.1,"10.1103/PhysRevB.18.5740"]
["LaZnAsO","mp-549589",420204,0.4092,0.3004,0.5293,0.4242,0.4741,0.4748,0.2443,0.8433,1.2914,0.761,1.3232,1.5199,1.4804,1.9299,1.6125,1.5,"10.1016/j.tsf.2007.10.035"]
["LaZnPO","mp-7060",85777,0.4719,0.4364,0.6318,0.5978,0.5525,0.6396,0.3418,0.856,1.4132,0.8822,1.4785,1.6931,1.6619,2.1049,1.7903,1.7,"10.1016/j.tsf.2007.10.035"]
["LiAsS2","mp-555874",419061,1.0192,0.9971,1.1057,1.0795,1.0403,1.56,1.553,1.1852,1.4216,1.2716,1.7345,1.7375,1.8831,2.3828,2.1007,1.6,"10.1002/anie.200801392"]
["LiAsSe2","mp-1078724",248116,0.7321,0.6931,0.7661,0.7299,0.7447,1.0204,0.9948,0.8717,0.9807,0.8843,1.2299,1.2278,1.3066,1.831,1.4288,1.11,"10.1021/ja9094846"]
["LiBr","mp-23259",52236,4.6529,4.4769,4.9437,4.7679,4.773,6.9522,6.7577,5.5052,6.493,5.7226,6.1698,6.5173,6.5207,6.6669,6.5263,7.6,"10.1002/pssb.19700380132"]
["LiCl","mp-22905",26909,6.0023,5.9627,6.327,6.2827,6.1263,8.5131,8.4659,6.923,8.267,7.1788,7.7399,8.1664,8.4108,8.2785,8.8947,9.4,"10.1002/pssb.19700380132"]
["LiCoO2","mp-24850",51767,0.9031,0.8971,1.1159,0.9668,0.9843,0.5935,0.5315,1.7853,3.4801,2.347,4.2033,6.2117,7.1567,4.8863,7.6063,2.1,"10.1016/S0038-1098(02)00325-3"]
["LiF","mp-1138",62361,8.8405,8.8199,9.0776,9.0561,8.9053,11.7464,11.724,10.1269,12.0827,9.9787,11.389,12.7321,15.0876,11.9431,15.9699,13.6,"10.1016/0022-3697(67)90280-6"]
["LiGaTe2","mp-5048",162555,1.6656,1.3968,1.7841,1.5292,1.7215,2.2668,1.9984,2.0266,2.3569,2.0195,2.5071,2.5649,2.6298,3.124,2.7901,2.65,"10.1021/cg050076c"]
["LiH","mp-23703",173177,2.654,2.6542,3.0035,3.0034,2.7616,4.188,4.1888,3.7129,4.6464,3.6396,3.9918,4.2051,4.1475,4.6617,4.161,4.94,"10.1143/JPSJ.57.367"]
["LiInI4O12","mp-973966",422056,3.3363,3.2925,3.4471,3.3854,3.3776,3.6605,3.5535,3.8282,4.4892,3.7921,4.8341,5.3307,6.0141,5.336,6.7383,4.27,"10.1039/C0DT01272F"]
["LiInSe2","mp-20310",60838,1.635,1.5191,1.8548,1.7393,1.7483,2.6228,2.4957,2.1388,2.8034,2.2242,2.7719,2.9906,3.0211,3.4131,3.1775,3.01,"10.1063/1.1478139"]
["LiIO3","mp-22955",35473,0.5868,0.4076,0.6202,0.4402,0.5988,0.606,0.4241,0.8385,1.0473,0.771,1.3057,1.5211,1.7797,1.9147,2.4009,6.1,"10.1103/PhysRevB.73.115110"]
["LiNbO3","mp-3731",28294,3.3557,3.3266,3.4163,3.3849,3.3789,3.0969,3.0886,3.6603,4.2186,3.8581,4.8173,5.4338,6.2589,5.3004,7.0318,3.78,"10.1063/1.346951"]
["LiTaO3","mp-3666",239372,3.1338,3.0631,3.2547,3.1795,3.183,2.972,2.9075,3.5443,4.6682,3.6231,4.6743,5.3408,6.1214,5.4258,6.026,4.7,"10.1021/jp004386b"]
["LiZnAs","mp-9124",74504,0.4395,0.3424,0.6362,0.5421,0.5521,1.3499,1.2407,0.9834,1.6317,0.9317,1.524,1.8413,1.6733,2.155,1.7616,1.61,"10.1103/PhysRevB.49.11452"]
["LiZnN","mp-7575",16790,0.7237,0.7114,0.6629,0.6486,0.6314,1.5752,1.5728,1.4425,1.9072,0.9574,1.8856,2.3781,2.6469,2.5885,3.2109,1.91,"10.1016/S0022-0248(98)00984-1"]
["LiZnP","mp-10182",642242,1.2373,1.2216,1.3563,1.3406,1.2335,2.3308,2.3112,1.6525,2.0551,1.6484,1.9491,1.9651,2.0484,2.504,2.2222,2.04,"10.1103/PhysRevB.37.7140"]
["Mg2Ge","mp-408",81735,0.1459,0.0799,0.1529,0.0896,0.0933,0.7054,0.6373,0.5364,0.6138,0.3759,0.5306,0.4822,0.4913,1.0426,0.45,0.69,"10.1103/PhysRev.109.1916"]
["Mg2Si","mp-1367",180944,0.1683,0.1569,0.2126,0.2017,0.1285,0.8814,0.8699,0.5169,0.6113,0.4544,0.5863,0.52,0.5213,1.1107,0.3324,0.78,"10.1103/PhysRev.109.1909"]
["Mg2Sn","mp-2343",104870,0,0,0,0,0,0.082,0,0.2591,0.3444,0.1029,0.2452,0.1609,0.2165,0.7352,0.0853,0.3]
["Mg3Sb2","mp-2646",245692,0.209,0.0708,0.2548,0.1224,0.23,0.7761,0.6485,0.6795,0.8297,0.4955,0.6203,0.534,0.5752,1.1348,0.4784,0.8,"10.1088/0022-3727/39/24/035"]
["MgCl2","mp-23210",86439,5.24,5.2282,5.6344,5.6211,5.4661,7.5408,7.5297,6.2099,7.7244,6.4474,7.0326,7.4536,7.8206,7.5532,8.2515,7.5,"10.1103/PhysRevB.9.2679"]
["MgF2","mp-1249",8120,6.8127,6.8122,7.1793,7.1754,7,9.9925,9.9921,8.2746,10.5279,7.9963,9.4714,10.8284,12.9926,9.876,13.8549,12.4,"10.1002/pssb.2220560115"]
["MgO","mp-1265",9863,4.621,4.6081,4.7108,4.6981,4.609,5.8099,5.7973,5.5698,6.7647,5.525,6.4405,7.2751,7.9731,7.1373,8.6324,7.672]
["MgSiP2","mp-2961",22189,1.1656,1.1631,1.2946,1.2921,1.1671,2.4296,2.4278,1.5887,1.9696,1.5732,1.9419,1.9673,1.9844,2.1629,1.776,2.409,"10.1002/pssb.2221060110"]
["MgTe","mp-1039",642882,2.3486,2.0928,2.566,2.3177,2.4448,3.6563,3.371,2.9903,3.5412,3.1814,3.3912,3.5109,3.4749,3.9031,3.4085,3.49]
["MoS2","mp-2815",95569,0.8084,0.8026,0.8969,0.8851,0.8532,1.1149,1.1685,0.9291,1.0803,0.9905,1.4662,1.4396,1.5559,2.0865,1.7001,1.23,"10.1021/j100393a010"]
["MoSe2","mp-1634",601045,0.753,0.7422,0.814,0.8006,0.7793,1.1788,1.1396,0.8824,0.9812,0.9418,1.3122,1.2554,1.3504,1.9151,1.3663,1.09,"10.1021/j100393a010"]
["MoTe2","mp-602",644476,0.7058,0.6744,0.7413,0.7085,0.7272,0.8823,0.8257,0.7845,0.8224,0.8988,1.1679,1.0892,1.1763,1.5092,1.0703,1.03,"10.1002/pssb.2220940132"]
["Na2CdSnS4","mp-561075",281233,1.7752,1.7732,2.0324,2.0243,1.9248,2.9198,2.9174,2.4155,3.3195,2.4394,3.0568,3.2985,3.4689,3.3156,3.8712,1.52,"10.1039/B110254K"]
["Na2KSb","mp-15724",44332,0.5781,0.4,0.7652,0.5937,0.7092,1.2952,1.0922,1.15,1.7668,1.3099,1.3551,1.375,1.3755,1.9205,1.3549,1]
["Na2TeSe3","mp-573581",430312,1.1695,1.0787,1.284,1.193,1.2225,1.6641,1.5618,1.413,1.6981,1.4648,1.9649,2.006,2.1456,2.4314,2.2399,1.95]
["Na2Ti3O7","mp-3488",250000,3.0503,3.0497,3.1229,3.1189,3.0976,2.757,2.7549,3.2185,3.9769,3.5062,4.7693,5.5716,6.6772,5.0011,7.5266,3.51,"10.1016/j.jssc.2017.03.017"]
["Na3Sb","mp-7956",26882,0.3172,0.1416,0.423,0.2514,0.3842,1.1146,0.908,0.9289,1.3157,0.8757,0.9346,0.9517,0.9163,1.4183,0.8397,1.1]
["NaAsS2","mp-5942",854,1.3392,1.335,1.454,1.444,1.3842,1.9766,1.9636,1.5605,1.9374,1.6404,2.1943,2.239,2.4446,2.6383,2.7096,2.23,"10.1002/anie.200801392"]
["NaBr","mp-22916",41440,3.7594,3.5867,4.1262,3.9583,3.9756,5.5462,5.3623,4.7724,6.2113,4.827,5.3191,5.5909,5.8398,5.8034,6.1389,7.1,"10.1103/PhysRevLett.19.496"]
["NaCl","mp-22862",181148,4.6941,4.6505,5.1001,5.0576,4.9276,6.4619,6.4164,5.7761,7.7144,5.8484,6.4578,6.7984,7.3245,7.009,7.3365,8.75,"10.1143/JPSJ.24.1286"]
["NaF","mp-682",262837,5.9551,5.9325,6.306,6.285,6.1675,8.42,8.3268,7.504,10.2484,7.0153,8.413,9.5672,11.9502,8.9927,12.8637,11.7,"10.1143/JPSJ.26.1427"]
["NaI","mp-23268",61502,3.3366,2.9942,3.6306,3.2959,3.4968,4.5959,4.2251,4.2143,5.1808,4.3508,4.6179,4.7491,4.8338,5.0945,4.9409,5.8,"10.1143/JPSJ.26.1427"]
["NaLa2TaO6","mp-13019",159206,3.9419,3.9034,4.0392,4.0007,4.0118,1.9916,1.8673,4.1605,4.7195,4.5921,5.7943,6.3849,6.988,6.4213,7.5161,4.5,"10.1016/j.jcrysgro.2007.10.030"]
["NaSbP2S6","mp-561303",155270,1.9702,1.8412,2.0873,1.9559,2.0273,2.266,2.0784,2.2189,2.6474,2.2723,2.9135,3.0234,3.1553,3.5666,3.2611,2.25,"10.1016/j.materresbull.2005.12.006"]
["NaTaO3","mp-3858",239690,2.5722,2.4304,2.7103,2.5638,2.6266,2.5229,2.3428,3.0249,4.1795,3.0759,4.1021,4.675,5.6688,4.5485,6.3364,4,"10.1021/jp004386b"]
["NaYbP2S6","mp-10838",93758,null,null,0,0,0,0,0,null,null,0,0,0,0,0.1838,0.1647,1.85,"10.1006/jssc.2001.9222"]
["Ne","mp-111",43427,11.4081,11.304,11.5831,11.4666,11.7535,15.1005,14.9205,13.9066,18.8484,12.7747,14.3022,16.2408,21.4895,15.1243,21.4967,21.48,"10.1016/0030-4018(86)90186-0"]
["OsAs2","mp-2455",238253,0.6667,0.6341,0.7046,0.6648,0.6847,0.7171,0.6659,0.7902,0.9195,0.918,1.342,1.5109,1.3729,1.9271,1.1678,0.92,"10.1021/ic501733z"]
["OsP2","mp-2319",238252,0.7555,0.688,0.7823,0.7064,0.7662,0.7351,0.7525,0.9064,1.0196,1.0452,1.4816,1.5757,1.4876,1.986,1.2114,1.13,"10.1021/ic501733z"]
["OsSb2","mp-2695",238254,0.4086,0.3852,0.4487,0.424,0.4256,0.3348,0.4037,0.4852,0.6188,0.5771,0.9844,1.0283,0.9925,1.535,0.8265,0.21,"10.1021/ic501733z"]
["P","mp-157",417180,0.0336,0.0337,0.0177,0.0064,0.0303,0.4309,0.4302,0.1093,0.0728,0.1018,0.2479,0.2631,0.2603,0.8404,0.1033,0.3125]
["P3N5","mp-567907",56876,3.5331,3.533,3.6714,3.6645,3.5828,4.0382,4.037,4.2623,5.1384,4.1108,5.0956,5.5644,6.0774,5.8327,6.6875,5.87,"10.1002/chem.201601149"]
["PbBr2","mp-28077",36170,2.929,2.4869,3.1329,2.6557,3.0215,4.1555,3.1874,3.5065,4.1305,3.4377,4.0714,4.2453,4.3593,4.5395,4.3712,3.98,"10.1002/pssb.2220570157"]
["PbCl2","mp-23291",27736,3.6927,3.1993,3.9027,3.3713,3.7774,5.091,4.0727,4.2447,4.9032,4.2572,4.8479,4.9864,5.262,5.5208,5.7772,4.863]
["PbCrO4","mp-19146",40920,1.7204,1.6713,1.7629,1.7131,1.7398,1.7803,1.7492,1.8354,1.983,2.0204,2.7086,2.9212,3.6783,3.3401,4.503,2.25,"10.1021/acs.inorgchem.5b01135"]
["PbCuSbS3","mp-649774",427413,0.5882,0.3923,0.67,0.4609,0.6136,1.4132,1.0165,0.8707,0.9842,0.8017,1.5508,1.6609,1.721,2.0494,1.6773,1.3,"10.1021/acs.cgd.5b00418"]
["PbF2","mp-315",86738,4.2535,3.9869,4.4287,4.1523,4.3177,6.1011,5.5968,5.1766,5.8918,4.8673,5.7441,6.1536,7.2005,6.3552,8.0533,5.68]
["PbI2","mp-22893",68819,2.0191,1.3661,2.1958,1.5244,2.0952,3.3293,2.0844,2.5418,2.9626,2.4823,2.8728,2.8886,3.0121,3.5081,3.3035,2.28,"10.1063/1.4939269"]
["PbMoO4","mp-25054",239428,2.6927,2.5872,2.7159,2.6163,2.6814,2.7851,2.737,2.9617,3.1737,3.0654,3.7199,3.9098,4.6279,4.3673,5.3962,3.6,"10.1016/j.optmat.2014.03.019"]
["PbS","mp-21276",62190,0.1788,0.1575,0.3016,0.0361,0.1936,1.5254,0.8772,0.6296,0.9978,0.581,0.7206,0.625,0.8091,1.3118,1.1835,0.286]
["PbSe","mp-2201",62195,0.14,0.2395,0.2445,0.1368,0.1574,1.3212,0.6249,0.5821,0.8335,0.5055,0.6295,0.5609,0.6835,1.1975,0.9828,0.145]
["PbSeO4","mp-22342",40921,3.4853,3.3079,3.6463,3.4546,3.5601,4.1304,4.0097,4.2254,5.0662,4.03,5.1068,5.6411,6.2789,5.5114,6.9239,4.3,"10.1021/acs.inorgchem.5b01135"]
["PbTe","mp-19717",63098,0.6131,0.0876,0.6853,0.0124,0.6192,1.4763,0.3861,0.942,1.1013,0.8616,1.0361,0.9398,1.0591,1.59,1.2638,0.187]
["PbWO4","mp-25176",81550,3.1376,2.9443,3.2025,3.0137,3.1477,3.2565,3.1405,3.5092,3.946,3.6017,4.2421,4.4252,5.1437,4.8924,5.8903,4.2,"10.1016/S0955-2219(03)00099-2"]
["PdS","mp-20250",61063,0.0164,0.022,0.0173,0.0207,0.0006,0,0,0.0232,0.1262,0.2059,0.8321,1.3382,1.1718,1.3382,1.1667,0.5,"10.1016/0022-3697(65)90140-X"]
["PdS2","mp-13682",648747,0,0,0,0,0,0,0,0.0642,0.2496,0.1593,0.8983,1.3494,1.2998,1.5104,1.4658,0.75,"10.1016/0022-3697(65)90140-X"]
["PdSe2","mp-2418",170327,0,0,0,0,0,0,0.0773,0.0036,0.117,0.1027,0.6325,0.9397,0.8481,1.2271,0.9659,0.4,"10.1016/0022-3697(65)90140-X"]
["PtSb2","mp-562",43105,0,0,0,0,0,0,0,0,0,0.0418,0.117,0,0.1265,0.6598,0.2048,0.11,"10.1016/0022-3697(83)90061-6"]
["Rb2AgVS4","mp-8901",66841,1.2565,1.2539,1.3458,1.3419,1.3074,1.3219,1.3198,1.4031,1.7436,1.5784,2.3663,2.5668,2.8263,2.974,3.1292,1.83,"10.1002/(SICI)1521-3749(199808)624:8<1285::AID-ZAAC1285>3.0.CO;2-5"]
["Rb2Cu2SnS4","mp-18006",74020,0.9897,0.9795,1.1377,1.1178,1.0663,1.9754,1.9696,1.4874,1.6664,1.4142,2.4184,2.9091,2.8949,3.0095,3.0262,2.08,"10.1021/cm00034a029"]
["Rb2CuNbS4","mp-15221",84304,1.9576,1.9521,2.02,2.0091,1.9907,2.1015,2.0956,2.0813,2.2066,2.26,3.0506,3.2493,3.4907,3.674,3.7955,2.64,"10.1021/ic025936i"]
["Rb2CuNbSe4","mp-15222",84305,1.624,1.5873,1.6818,1.6456,1.6526,1.77,1.7163,1.7855,1.8921,1.9244,2.5795,2.7125,2.8831,3.209,3.1397,2.19,"10.1021/ic025936i"]
["Rb2CuVS4","mp-15219",84302,1.1864,1.1847,1.2525,1.2467,1.2236,1.2438,1.2404,1.2959,1.5311,1.4516,2.3126,2.6156,2.8044,2.9342,3.0866,1.85,"10.1021/ic025936i"]
["Rb2TeBr6","mp-23383",49521,1.8009,1.7259,1.9024,1.8318,1.8522,2.3562,2.2015,2.0943,2.374,2.0212,2.5156,2.5506,2.7783,3.1346,3.2337,2.19,"10.1134/S0020168511010109"]
["Rb2TeI6","mp-28070",36009,1.3758,1.1139,1.4931,1.2192,1.4346,1.7623,1.4585,1.6682,1.8053,1.6343,1.9987,1.983,2.1165,2.5063,2.3573,1.43,"10.1134/S0020168511010109"]
["Rb2TiCu2S4","mp-7129",280644,1.5456,1.5428,1.612,1.6057,1.5675,1.7787,1.7792,1.6984,1.8133,1.7974,2.5748,2.8396,2.9465,3.1175,3.1604,2.19,"10.1021/ic001346d"]
["Rb3Sb2Br9","mp-28222",39823,1.7053,1.621,1.7772,1.6774,1.7237,2.3719,2.1174,2.042,2.2815,1.9291,2.3511,2.364,2.6168,2.9591,3.1075,2.48,"10.1134/S0020168511010109"]
["RbAg2SbS4","mp-17756",82145,0.6629,0.6582,0.8437,0.828,0.7593,1.6016,1.584,1.1263,1.5961,1.0868,1.9146,2.2743,2.3374,2.2214,2.2445,2.3,"10.1006/jssc.1996.0179"]
["RbAu","mp-30373",58428,0.1167,0.097,0.2007,0.1794,0.1278,1.1983,1.1545,0.5073,0.5608,0.8555,0.2412,0,0.1894,0.8023,0.7931,2.75,"10.1002/bbpc.19840881007"]
["RbBr","mp-22867",22167,3.9432,3.7763,4.3578,4.1958,4.2102,6.5191,6.3418,4.9699,6.435,4.859,5.5138,5.7819,6.0813,5.9486,6.6576,7.2,"10.1103/PhysRevLett.19.496"]
["RbCl","mp-23295",18016,4.6085,4.5599,5.0579,5.0115,4.8986,7.3371,7.2189,5.7225,7.5826,5.5764,6.3619,6.7134,7.2006,6.6593,7.4065,8.3,"10.1103/PhysRev.155.896"]
["RbCu2VS4","mp-15998",280516,1.0401,1.0389,1.0941,1.0852,1.0702,1.0562,1.0377,1.0901,1.2965,1.2768,2.1201,2.41,2.5814,2.7281,2.8629,1.45,"10.1107/S0108270100019442"]
["RbF","mp-11718",53828,5.3247,5.281,5.7213,5.6674,5.573,8.3782,8.26,6.8002,8.7774,6.2477,7.6407,8.6465,9.7469,8.0331,9.7332,10.4,"10.1103/PhysRev.116.1099"]
["RbI","mp-22903",22168,3.5535,3.231,3.9172,3.6022,3.7724,5.9314,5.5752,4.455,5.5087,4.4319,4.8904,5.0205,5.1844,5.2438,5.5745,6.37,"10.1103/PhysRev.141.797"]
["ReS2","mp-572758",81814,1.219,1.0668,1.2446,1.0871,1.2343,1.2015,0.9915,1.2995,1.3815,1.3382,1.8435,1.8032,1.9763,2.4012,2.0875,1.37,"10.1063/1.365357"]
["ReSe2","mp-541582",81813,0.9918,0.8963,1.044,0.9435,1.006,1.0654,0.9183,1.1339,1.2517,1.1968,1.6436,1.5717,1.7244,2.2791,1.7189,1.19,"10.1063/1.365357"]
["RuS2","mp-2030",68472,0.7035,0.6943,0.784,0.7598,0.7482,1.1068,1.1141,1.0429,1.2514,1.0304,1.8654,2.2547,2.0981,2.366,1.8717,1.45,"10.1088/0953-8984/7/21/015"]
["RuSe2","mp-1922",68473,0.3687,0.3588,0.4475,0.4224,0.4088,0.7484,0.7707,0.6513,0.8108,0.7079,1.3497,1.6844,1.4946,1.9557,1.3588,0.76,"10.1088/0022-3719/18/32/018"]
["RuTe2","mp-1848",65169,0.0813,0.0647,0.1179,0.0862,0.0928,0.4175,0.4077,0.2215,0.3262,0.1822,0.6903,0.7495,0.7202,1.3341,0.6757,0.491,"10.1016/0038-1098(96)00041-5"]
["Sb2O3","mp-2136",240207,2.0638,2.0577,2.127,2.116,2.0465,3.2411,3.2127,2.5012,2.803,2.4091,2.9825,3.0816,3.3925,3.6398,3.9221,3.25,"10.1002/pssb.2220540234"]
["Sb2O3","mp-1999",240206,3.0347,2.9737,3.1785,3.1136,3.071,4.3371,4.2219,3.5717,4.1051,3.4782,4.1705,4.3027,4.6605,4.8222,5.1902,4,"10.1002/pssb.2220540234"]
["Sb2S3","mp-2809",171850,1.188,1.1559,1.2731,1.2388,1.2039,1.806,1.7325,1.4054,1.643,1.4201,1.7983,1.8077,1.8919,2.3776,2.0333,1.74,"10.1016/0040-6090(95)06577-6"]
["Sb2Se3","mp-2160",194836,0.866,0.8008,0.9551,0.8817,0.8989,1.332,1.1975,1.0957,1.3128,1.0822,1.4701,1.4948,1.5184,1.7143,1.5325,1.11]
["Sb2Te3","mp-1201",193341,0.0703,0.2237,0.0271,0.2313,0.0685,0.3416,0.1382,0.1066,0.2123,0.0543,0.2321,0.2486,0.2371,0.6483,0.2246,0.28]
["SbF3","mp-1880",16142,4.3888,4.3467,4.5436,4.4981,4.4601,5.6505,5.4883,4.9163,5.6057,4.9407,5.7248,5.9615,7.0541,6.372,8.0054,4.3,"10.1016/j.optmat.2008.01.018"]
["SbI3","mp-569224",30906,2.2209,1.9175,2.338,2.0284,2.2748,2.6606,2.2113,2.5166,2.7505,2.5535,3.1131,3.1568,3.248,3.6216,3.2405,2.41]
["SbNSr3","mp-7752",152052,0.1872,0.1249,0.212,0.1595,0.1873,1.056,0.9672,0.5805,0.8417,0.4979,0.9014,0.9602,0.9281,1.5111,0.8888,1.15,"10.1002/zaac.200400256"]
["SbSBr","mp-22971",88584,1.5229,1.4581,1.6494,1.5761,1.5603,2.2511,2.0946,1.8017,2.1626,1.8387,2.3452,2.3956,2.4897,2.7027,2.6888,2.265,"10.1088/0268-1242/10/8/021"]
["SbSeI","mp-22996",35470,1.2857,1.1501,1.3897,1.2537,1.324,1.7509,1.4943,1.5815,1.8152,1.5711,2.0463,2.11,2.1137,2.5896,2.091,1.7,"10.1021/ic401086r"]
["SbSI","mp-23041",85301,1.5039,1.306,1.6155,1.4182,1.5458,2.0061,1.6815,1.7869,2.058,1.8007,2.2828,2.3541,2.3679,2.8546,2.4063,1.88]
["ScN","mp-2857",644666,0,0,0,0,0,0.3672,0.3463,0.1868,0.9182,0.295,0.9078,1.3241,1.3947,1.5909,1.8048,0.9,"10.1103/PhysRevB.70.045303"]
["ScNiSb","mp-3432",40296,0.2894,0.2632,0.2999,0.275,0.2883,0.2526,0.2363,0.1898,0.3314,0.3842,0.4371,0.0683,0.4461,1.0775,0.7443,0.11,"10.1088/0953-8984/15/4/304"]
["ScPdSb","mp-569779",415944,0.3199,0.2632,0.3121,0.2569,0.3077,0.2665,0.2272,0.2422,0.2664,0.422,0.5223,0.2798,0.5406,1.1506,0.8196,0.23,"10.1088/0953-8984/15/4/304"]
["Si","mp-149",51688,0.5169,0.5004,0.6187,0.6028,0.505,1.4859,1.4696,0.9016,1.1994,0.8742,1.2011,1.2147,1.1972,1.8309,1.102,1.17]
["Si3N4","mp-988",170004,4.13,4.13,4.312,4.3069,4.1757,5.0383,5.0305,4.8906,5.7349,4.9584,5.7799,6.2549,6.4715,6.5285,6.8322,5.1,"10.1063/1.1652607"]
["SiAs","mp-1863",43227,0.7139,0.7094,0.8078,0.8009,0.7252,1.5255,1.5064,1.021,1.3061,1.0355,1.3579,1.3508,1.3808,1.9645,1.3957,1.45]
["SiC","mp-8062",603798,1.2973,1.2926,1.3509,1.346,1.2267,2.1003,2.0933,1.856,2.2916,1.7117,2.2494,2.3526,2.3616,2.9766,2.3399,2.4161]
["SiC","mp-7140",86253,2.224,2.2192,2.3486,2.3436,2.1887,3.3288,3.3237,2.8283,3.3742,2.7235,3.2578,3.3956,3.3656,3.8278,3.2565,3.33]
["SiC","mp-11714",24170,2.1733,2.1686,2.2316,2.2268,2.1145,2.9335,2.9274,2.7062,3.11,2.5982,3.1746,3.2979,3.2904,3.88,3.2277,3.2]
["SiC","mp-7631",156190,1.9557,1.9508,2.0115,2.0066,1.8976,2.7083,2.7023,2.4698,2.8908,2.366,2.9249,3.0395,3.0382,3.6351,2.9941,2.86]
["SiO2","mp-7000",154289,5.7732,5.771,6.0193,6.0127,5.8973,7.5423,7.5591,6.8268,8.234,6.5814,7.8731,8.7225,9.7155,8.5405,10.4456,8.9,"10.1016/0038-1098(71)90643-0"]
["SiP2","mp-9996",43098,0.6879,0.6877,0.7982,0.7904,0.7031,1.5187,1.5185,0.8859,1.0872,0.9695,1.3915,1.3768,1.4104,1.8823,1.2977,1.89]
["Sn","mp-117",40039,0,0,0,0,0,0,0,0,0.0001,0,0,0.1702,0.1204,0.4165,0.029,0.094]
["Sn2SbS2I3","mp-561134",23344,0.3863,0.2773,0.4424,0.3289,0.3969,0.716,0.4197,0.5416,0.675,0.5901,0.8608,0.826,0.9168,1.2852,0.9906,1.5,"10.1002/crat.2170251214"]
["SnBr2","mp-29862",411177,2.216,2.1383,2.3255,2.2515,2.2426,3.2785,3.1315,2.6522,2.9219,2.6741,3.0438,3.0797,3.265,3.6175,3.5592,3.45,"10.1002/1521-3951(200102)223:3<723::AID-PSSB723>3.0.CO;2-S"]
["SnCl2","mp-569152",15452,2.8984,2.8485,3.0571,3.0069,2.9472,4.1496,4.0592,3.3779,3.8139,3.4109,3.9075,3.9734,4.2698,4.3236,4.7008,3.8,"10.1063/1.3576118"]
["SnO2","mp-856",154960,1.2027,1.2057,1.341,1.3324,1.2453,1.6143,1.6169,1.9946,3.2254,1.9365,3.1336,4.115,4.8494,3.8331,5.512,3.596]
["SnS","mp-2231",52108,0.7014,0.6874,0.7287,0.715,0.6791,1.3684,1.3434,0.9445,1.0134,0.914,1.072,0.9944,1.1282,1.5738,1.3378,1.23,"10.1016/j.solmat.2003.06.002"]
["SnS2","mp-1170",100610,1.2333,1.2329,1.4288,1.4233,1.335,1.9129,1.9093,1.4658,2.0494,1.6707,2.3137,2.4625,2.5804,2.8477,2.6698,2.48,"10.1039/c5ta08214e"]
["SnSe","mp-691",186650,0.52,0.4953,0.6013,0.5773,0.5369,1.1069,1.1104,0.8501,1.0094,0.8189,1.0333,0.9949,1.0709,1.5469,1.2177,0.9]
["SnSe2","mp-665",43594,0.5423,0.5184,0.6918,0.6627,0.6147,1.2444,1.202,0.8137,1.2464,0.9187,1.3999,1.4835,1.5528,1.9527,1.6528,0.97]
["SnTe","mp-1883",52489,0.0901,0.2484,0.0866,0.2405,0.1323,0.532,0.2221,0.1614,0.1869,0.0792,0.1044,0.0072,0.1074,0.6391,0.3122,0.36,"10.1103/PhysRev.184.830"]
["Sr2PbO4","mp-20944",4418,1.5132,1.5169,1.6286,1.6336,1.5629,2.187,2.199,1.9411,2.6493,1.825,2.7102,3.1191,3.6536,3.0541,4.2793,1.75,"10.1039/c5ta02349a"]
["Sr2TiO4","mp-5532",194713,1.9511,1.9503,2.0375,2.036,1.9921,1.8419,1.8378,2.1623,2.8244,2.4106,3.5009,4.248,4.7161,4.2745,5.3366,3.41,"10.1016/j.jallcom.2008.10.054"]
["Sr3Ti2O7","mp-3349",63704,1.8538,1.8535,1.9419,1.9398,1.8949,1.7431,1.7751,2.0745,2.7396,2.3071,3.3919,4.1309,4.6291,3.9843,5.1808,3.26,"10.1016/j.jallcom.2008.10.054"]
["SrBiO2Cl","mp-547244",84636,3.1997,3.0511,3.3283,3.1822,3.2457,4.2165,3.6999,3.6677,4.2247,3.646,4.4659,4.7716,5.0915,5.1353,5.581,3.52,"10.1016/j.materresbull.2014.11.032"]
["SrCl2","mp-23209",196826,4.9015,4.9001,5.3574,5.3556,5.155,7.1779,7.2138,5.9323,7.2377,5.9156,6.6561,7.0204,7.3962,7.2548,7.8793,7.5,"10.1103/PhysRevB.9.2679"]
["SrCrO4","mp-542885",40922,2.8978,2.897,2.9501,2.9445,2.9274,2.699,2.7165,3.0548,3.4875,3.2366,4.3759,4.9236,5.9243,5.142,6.809,2.45,"10.1021/acs.inorgchem.5b01135"]
["SrCu2O2","mp-13900",25002,1.8328,1.8058,1.868,1.8209,1.8155,2.2984,2.2642,2.1159,2.1222,2.1253,3.2079,3.82,4.0456,3.9065,3.938,3.3,"10.1063/1.121761,10.1063/1.1445498"]
["SrF2","mp-981",40414,6.6101,6.605,7.0028,7.0005,6.8389,9.633,9.604,8.1245,10.2077,7.5096,9.0632,10.2288,11.7063,9.7201,12.4369,9.6,"10.1364/OL.13.000814"]
["SrGe2","mp-1244",152799,0.3846,0.3864,0.4231,0.4241,0.3918,0.7156,0.7373,0.4997,0.627,0.5497,0.7921,0.7248,0.8138,1.3659,0.924,0.82,"10.1002/pssc.201300375"]
["SrMoO4","mp-18834",239418,4.0654,4.0515,4.1186,4.1028,4.0803,3.92,3.9111,4.3934,4.9698,4.5372,5.622,6.1996,7.0895,5.9881,7.8249,3.98,"10.1016/j.cej.2008.01.015"]
["SrO","mp-2472",163625,3.1091,3.0886,3.2644,3.2444,3.1572,4.6362,4.6173,3.8641,4.9272,3.7319,4.7518,5.3393,5.7633,5.2785,6.2445,6.1,"10.1103/PhysRevB.81.245123"]
["SrPbO3","mp-20489",78682,0.8686,0.8567,0.8883,0.8867,0.8739,0.9737,0.9785,0.8678,1.1281,0.9356,1.4701,1.6255,2.1441,1.9392,2.6922,1.78,"10.1016/j.jpcs.2007.03.013"]
["SrS","mp-1087",249177,2.2403,2.2036,2.4521,2.4165,2.3203,3.8343,3.7988,2.7185,3.5126,2.8766,3.4312,3.5685,3.663,4.099,3.8468,4.32,"10.1016/0022-0248(90)90701-L"]
["SrSe","mp-2758",52429,2.0085,1.8716,2.1681,2.0355,2.0615,3.4956,3.3514,2.4819,3.0829,2.6181,3.0438,3.1419,3.1817,3.6997,3.2936,3.813,"10.1016/0022-0248(90)90701-L"]
["SrSeO4","mp-4092",40923,3.8865,3.8859,4.1086,4.0871,4.0106,4.4914,4.4924,4.7653,6.2343,4.5829,6.0532,7.086,7.8122,6.3223,8.5276,4.75,"10.1021/acs.inorgchem.5b01135"]
["SrSnO3","mp-2879",238971,2.0008,2.0021,2.1176,2.1147,2.0469,2.1837,2.1951,2.5333,3.5913,2.6508,3.679,4.5054,4.9833,4.2432,5.4575,4.1,"10.1021/ic034551c"]
["SrTaO2N","mp-552454",411137,0.1609,0.0547,0.3234,0.1938,0.2251,0.6232,0.4457,0.5934,1.8503,0.644,1.6063,2.1396,2.4433,2.2814,2.9319,1.99,"10.1107/S2052520617001123"]
["SrTiO3","mp-5229",94573,1.7318,1.7157,1.8249,1.8077,1.7742,1.7018,1.6825,1.9613,2.6498,2.1864,3.2761,4.0209,4.5508,3.9402,5.0605,3.25,"10.1063/1.1415766"]
["SrZrS3","mp-5193",154104,1.0679,1.0283,1.1396,1.1005,1.0638,1.4029,1.3466,1.2218,1.7151,1.5324,1.9522,2.1473,2.1689,2.5678,2.2992,1,"10.1016/j.solidstatesciences.2005.02.010"]
["TaON","mp-4165",192423,1.5559,1.5221,1.6803,1.6414,1.5995,1.754,1.6889,1.9,2.7914,1.9753,2.799,3.1099,3.5574,3.4296,4.0619,2.4,"10.1021/jp027593f"]
["TeO2","mp-557",161691,2.5007,2.3934,2.5766,2.4635,2.5061,2.909,2.7988,2.8754,3.2994,2.8455,3.6623,3.9513,4.4047,4.3162,4.9768,3.5,"10.1016/0022-3697(87)90081-3"]
["TeO2","mp-8377",90733,2.9012,2.79,2.984,2.8637,2.9134,3.3781,3.2266,3.3291,3.7835,3.2936,4.134,4.4793,4.9034,4.5973,5.1711,3.41,"10.1016/j.jcrysgro.2007.03.054"]
["ThO2","mp-643",105550,4.3125,4.2088,4.404,4.2942,4.3524,3.2732,3.0237,4.8821,5.5321,4.9206,6.1325,6.83,7.1632,6.7548,7.5857,5.9,"10.1016/S0020-1693(99)00597-6"]
["ThOS","mp-8136",31654,0.8207,0.6979,0.9595,0.8366,0.8425,1.2343,0.9912,1.2318,1.8285,1.4134,1.9201,2.1022,2.1527,2.5996,2.292,2.22,"10.1021/ic300510x"]
["ThOSe","mp-7950",26654,0.6411,0.3967,0.7297,0.4859,0.6443,0.8275,0.4263,1.0226,1.437,1.1956,1.5564,1.7031,1.7004,2.229,1.7932,1.65,"10.1021/ic300510x"]
["ThOTe","mp-3718",65950,0.0965,0.2299,0.1392,0.2319,0.0773,0.3973,0.1089,0.4146,0.6535,0.4902,0.7352,0.7766,0.7848,1.3739,0.8489,1.46,"10.1021/ic300510x"]
["TiO2","mp-2657",167953,2.0791,2.074,2.1607,2.1548,2.1245,2.0092,2.0081,2.2285,2.9636,2.5003,3.657,4.4751,5.2954,4.2747,5.9355,3.03,"10.1103/PhysRevB.18.5606"]
["TiO2","mp-390",92363,1.9646,1.9643,2.0622,2.0603,2.0164,1.8854,1.8943,2.1543,2.8948,2.432,3.5469,4.3642,5.3166,4.1976,6.0171,3.3,"10.1016/0038-1098(93)90427-O"]
["Tl2AuPS4","mp-9510",85680,0.8425,0.7674,1.0316,0.9448,0.9191,2.1871,2.0944,1.3654,1.7493,1.2389,1.7701,1.7129,1.9165,2.2865,2.1727,2.2,"10.1002/(SICI)1099-0682(199802)1998:2<283::AID-EJIC283>3.0.CO;2-L"]
["Tl2Cu2SnS4","mp-18240",171221,0.3482,0.2695,0.4689,0.3858,0.3978,1.4315,1.3351,0.7449,0.9775,0.6077,1.3165,1.5212,1.5532,1.9105,1.728,1.4,"10.1021/cm050412c"]
["Tl2TeBr6","mp-31076",99127,1.7342,1.5902,1.8256,1.692,1.7789,2.1619,1.9541,2.0065,2.2345,1.9493,2.419,2.4574,2.6296,2.7455,2.7291,2.06,"10.1134/S0020168511010109"]
["Tl2TeI6","mp-31077",99128,1.4641,1.2194,1.5616,1.3095,1.5111,1.8272,1.4507,1.7301,1.8771,1.7255,2.1172,2.1118,2.2177,2.7297,2.2658,1.47,"10.1134/S0020168511010109"]
["Tl2TeS3","mp-17172",391285,1.0851,1.0142,1.1892,1.1124,1.1159,1.7926,1.7034,1.3571,1.5704,1.3962,1.7333,1.6928,1.857,2.3344,2.1377,1.6,"10.1002/zaac.200670073"]
["Tl3AsSe3","mp-7684",15148,0,0,0,0,0,0,0,0,0,0,0,0,0.0175,0.3607,0.1849,1.3,"10.1021/cm401737s"]
["Tl4CdI6","mp-570339",60756,1.8718,1.5548,2.0237,1.7109,1.922,3.04,2.8161,2.3992,2.8031,2.3793,2.6332,2.606,2.725,2.8815,2.7099,2.8,"10.1021/cg5001446"]
["TlBr","mp-22875",61532,1.6562,1.1738,1.8482,1.3412,1.7212,3.5073,2.754,2.3598,2.8322,2.2667,2.5362,2.5532,2.6939,3.1542,3.0546,2.66,"10.1063/1.4874265"]
["TlCl","mp-23167",5253,1.962,1.6881,2.1796,1.8941,2.0394,3.9324,3.3481,2.6955,3.362,2.5856,2.9671,3.0069,3.2285,3.6089,3.696,3.225]
["TlGaTe2","mp-3785",16243,0.2475,0.1795,0.334,0.264,0.284,1.0523,0.9356,0.6157,0.7995,0.616,0.8392,0.7755,0.8805,1.4159,1.0071,1.2]
["TlI","mp-23197",61520,1.4672,0.7072,1.6236,0.8539,1.5241,3.135,2.1045,2.099,2.4366,1.9046,2.2409,2.1396,2.2985,2.8391,2.5556,2.1]
["TlI","mp-22858",258845,1.8769,1.4399,2.0167,1.5785,1.9185,3.3789,2.6529,2.3874,2.7167,2.4182,2.605,2.5598,2.7021,3.1516,2.9216,2.867]
["TlI","mp-571102",60491,1.7723,1.4799,1.9475,1.6503,1.834,3.6553,2.9986,2.3846,2.7599,2.284,2.5231,2.4269,2.6432,3.1412,3.0681,2.92]
["TlInSe2","mp-22232",180272,0,0,0,0,0,0.4507,0.4503,0.0776,0.2244,0.1202,0.4299,0.3736,0.4918,1.0253,0.719,1.19]
["TlInTe2","mp-22791",16245,0.3313,0.2611,0.4312,0.3593,0.3719,1.0971,0.9729,0.6582,0.853,0.7254,0.9327,0.8854,0.9693,1.5135,1.0715,0.963]
["TlS","mp-322",78161,0.5095,0.4896,0.6402,0.6128,0.5612,1.1907,1.1903,0.786,1.1377,0.8332,1.3422,1.3906,1.5288,1.9787,1.802,1.36]
["TlScS2","mp-13312",418474,0.7686,0.6957,0.8964,0.8223,0.8013,1.4543,1.4209,1.0864,1.5754,1.1345,1.3995,1.353,1.5081,2.0222,1.8432,1.51,"10.1002/zaac.200700440"]
["TlScSe2","mp-13313",418475,0.4559,0.369,0.5488,0.4807,0.4881,1.0351,0.9424,0.714,1.0613,0.8392,1.0251,0.9638,1.0829,1.6146,1.3701,0.79,"10.1002/zaac.200700440"]
["TlScTe2","mp-13314",418476,0,0,0,0,0,0.4334,0.2256,0.0689,0.2863,0.1663,0.4298,0.4628,0.4826,1.0181,0.5752,0.85,"10.1002/zaac.200700440"]
["TlSe","mp-1836",104189,0.0139,0,0.1106,0.0786,0.0478,0.6577,0.6405,0.2874,0.5177,0.3265,0.6719,0.6827,0.7811,1.2737,0.9948,0.73]
["TlTaS3","mp-10795",412385,0.3847,0.3841,0.4399,0.4362,0.3962,0.6498,0.6687,0.4847,0.6504,0.6431,0.9741,0.9145,1.1135,1.6141,1.4003,0.78,"10.1002/1521-3749(200207)628:7<1511::AID-ZAAC1511>3.0.CO;2-P"]
["TlTiPS5","mp-558747",171214,0.9655,0.9632,1.0293,1.0258,0.9962,1.0098,1.0104,1.0158,1.2559,1.263,1.8343,1.9729,2.0863,2.2905,2.2255,1.3,"10.1021/cm050412c"]
["WS2","mp-224",202366,0.9083,0.8637,0.997,0.9453,0.95,1.3891,1.3054,1.0359,1.1895,1.1072,1.5331,1.4922,1.6027,2.1576,1.7417,1.35,"10.1021/j100393a010"]
["WSe2","mp-1821",40752,0.8878,0.8155,0.9487,0.8748,0.911,1.3443,1.1499,1.0326,1.133,1.1002,1.4275,1.362,1.457,2.0047,1.4868,1.2,"10.1021/j100393a010"]
["Xe","mp-611517",43428,5.7965,5.5988,6.2617,5.8157,6.0974,8.8763,8.3728,6.8636,8.1494,6.9313,7.3789,7.57,7.8697,7.917,8.3869,9.29,"10.1016/0030-4018(86)90186-0"]
["YF3","mp-2416",6023,7.6481,7.7281,7.8407,7.8319,7.7561,8.2206,8.2091,8.4834,9.4304,8.6543,10.2024,11.4937,12.9518,10.9718,12.7633,12.5,"10.1016/j.jlumin.2004.09.117"]
["YNiSb","mp-11520",105331,0.2953,0.2657,0.3157,0.2855,0.3032,0.2653,0.2253,0.1835,0.3646,0.431,0.4631,0.1479,0.4675,1.0796,0.701,0.18,"10.1088/0953-8984/15/4/304"]
["YPtSb","mp-4964",44970,0.2787,0.0813,0.4149,0.2173,0.3781,0.2862,0.0878,0.3275,0.6051,0.2251,0.9235,0.7336,0.9428,1.5529,1.1316,0.16,"10.1088/0953-8984/15/4/304"]
["ZnAl2S4","mp-4842",35380,2.3487,2.3061,2.5236,2.4822,2.4224,3.5345,3.5085,2.749,3.319,2.9299,3.491,3.6308,3.6842,4.0746,3.4552,3.5,"10.7567/JJAPS.32S3.586"]
["ZnAs2","mp-7262",2021,0.1544,0.1417,0.2709,0.253,0.2077,0.8104,0.7959,0.381,0.7518,0.4434,0.9104,0.9574,1.052,1.512,1.2736,0.973]
["ZnGa2Se4","mp-15776",44887,1.4236,1.2908,1.6592,1.5268,1.5575,2.4822,2.3463,2.0022,2.7373,2.0378,2.6839,3.0123,2.9852,3.2819,3.1579,2.18]
["ZnGa2Te4","mp-15777",290911,0.9329,0.6498,1.0379,0.7595,0.9747,1.7805,1.4544,1.3167,1.6257,1.227,1.6699,1.7091,1.7716,2.2787,1.9613,1.33,"10.1016/j.materresbull.2011.06.002"]
["ZnGeAs2","mp-4008",68324,0.0951,0.0187,0.2943,0.2179,0.2369,0.6009,0.5192,0.5025,1.182,0.4537,1.1491,1.4691,1.3618,1.7097,1.4661,1.15]
["ZnGeN2","mp-2979",15144,1.7654,1.7639,1.7567,1.7522,1.7132,2.6592,2.6587,2.4439,2.9067,2.0429,3.124,3.671,4.0288,3.78,4.5264,3.36,"10.1002/pssc.200390019"]
["ZnGeP2","mp-4524",23706,1.1657,1.1538,1.3074,1.2936,1.2361,1.8526,1.8432,1.4959,1.9136,1.5396,2.0684,2.0936,2.2228,2.6973,2.4714,2.02,"10.1016/j.jcrysgro.2008.08.065"]
["ZnIn2Te4","mp-20832",25650,1.0546,0.7717,1.2467,0.9693,1.1541,1.9413,1.6421,1.5051,2.0419,1.4706,2.0715,2.2489,2.2329,2.6565,2.3455,1.49,"10.1103/PhysRevB.68.235201"]
["ZnO","mp-2133",162843,0.7404,0.7214,0.8044,0.7832,0.7002,3.0341,3.0313,1.8534,2.5558,1.1417,2.5116,3.4773,4.1292,3.1354,4.8136,3.44]
["ZnP2","mp-1392",250015,0.6664,0.6659,0.7686,0.7628,0.6904,1.4217,1.4206,0.9222,1.2653,1.0276,1.4797,1.4922,1.6389,2.121,1.8494,1.42]
["ZnS","mp-10695",291064,1.9053,1.8833,2.1466,2.1253,2.009,3.7361,3.7068,2.7238,3.6476,2.6258,3.3824,3.822,3.8508,4.0377,4.1608,3.723]
["ZnS","mp-560588",67453,1.9357,1.9139,2.1811,2.16,2.0447,3.7398,3.7105,2.7472,3.666,2.6633,3.4135,3.8496,3.882,4.0562,4.1769,3.91]
["ZnSb","mp-753",43265,0.0415,0.0221,0.1298,0.1091,0.0935,0.5778,0.4889,0.3131,0.6135,0.1415,0.6641,0.7024,0.7027,1.1815,0.704,0.5]
["ZnSe","mp-1190",77091,1.0489,0.9191,1.3076,1.1817,1.1876,2.6323,2.4844,1.8166,2.6973,1.7126,2.4218,2.8588,2.7623,3.0423,2.985,2.8222]
["ZnSiAs2","mp-3595",68323,1.0431,0.9825,1.1391,1.0791,1.0387,1.4475,1.3788,1.4644,1.7512,1.364,1.7498,1.7668,1.8272,2.372,1.9801,1.93]
["ZnSiP2","mp-4763",23680,1.177,1.1726,1.3004,1.2949,1.1787,2.3236,2.2869,1.5554,1.9131,1.5423,1.9822,2.017,2.0758,2.591,2.1567,2]
["ZnSnAs2","mp-5190",250389,0.0134,0.0069,0.1288,0.0281,0.0535,0.5555,0.4498,0.3332,0.9915,0.2827,0.9331,1.2164,1.1136,1.5031,1.2271,0.745]
["ZnSnO3","mp-13334",245943,1.5268,1.5169,1.6087,1.5944,1.5224,2.5159,2.5377,2.3269,3.2248,2.1172,3.3615,4.3674,4.9717,3.8854,5.6142,3.9,"10.1039/B921010E"]
["ZnSnP2","mp-4175",22179,0.7941,0.7724,0.9855,0.9623,0.9043,1.5276,1.5082,1.2473,1.8497,1.272,1.874,2.1103,2.082,2.4918,2.199,1.683,"10.1063/1.3442917"]
["ZnSnSb2","mp-4756",651588,0.0189,0,0.0167,0.0073,0.017,0.0817,0.0117,0.0201,0.5282,0.0176,0.6407,0.8691,0.7733,1.1901,0.8387,0.4]
["ZrS2","mp-1186",604434,0.7361,0.7219,0.7952,0.7812,0.7233,1.0809,1.1047,0.8726,1.2891,1.1635,1.5764,1.6999,1.7797,2.1487,1.8911,1.68,"10.1016/0022-3697(65)90043-0"]
["ZrSe2","mp-2076",109291,0.3279,0.1741,0.3575,0.2107,0.3031,0.683,0.5665,0.5334,0.8151,0.7161,1.0213,1.1142,1.1388,1.5943,1.2198,1.18,"10.1103/PhysRevB.80.035206"]