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. 2020 Jul 21;5(30):18907–18918. doi: 10.1021/acsomega.0c02128

Table 5. Polarizability with Major Contributing Tensor (au) and Dipole Moments of the Compounds.

polarizability CPFH CCPH BCPH
αxx 288.066 296.872 301.461
αyy 223.919 244.863 254.400
αzz 81.109 84.086 87.390
αtotal 197.698 208.607 214.417
dipole moments CPFH CCPH BCPH
μx –2.0517 –2.2320 –2.3467
μy –0.7495 –1.1932 0.8968
μz 0.0030 0.0001 –0.0003
μtotal 2.184 2.531 2.512