. 2016 Dec 23;8(2):357–363. doi: 10.1021/acs.jpclett.6b02532

Table 2. Bulk Modulus Values Computed from Different Force Fields^a.

MOF	BTW-FF (ref ²⁰)	UFF	UFF4MOF	DREIDING	DWES	DFT/exp
IRMOF-1	13.6 (11.95)	14.5	16.8	22.0	17.5	15.3–18.5^b
IRMOF-10	9.0 (8.25)	7.6	10.4	9.7	8.1	6.0, 9.09^c
HKUST-1	23.9 (25.05)	28.7	29.4	31.1		24.5–34.66^d
UiO-66	27.1 (27.15)	42.4				41.0^e

Units in GPa.

Refs (24, 39, and 41−46).

Refs (47 and 48).

Refs (38 and 39).

Ref (46).

Table 2. Bulk Modulus Values Computed from Different Force Fieldsa.