ASE database

Displaying rows 26-50 out of 594

↓ ID ✕	Formula ✕	Calculator ✕	Charge ✕	str_E ✕	Maximum stress ✕	Volume ✕	Dipole_val ✕
26	Au₅₄O	vasp	0.000	-169.953	0.011	2654.442	1.316
27	Au₅₄F	vasp	0.000	-168.878	0.011	2654.442	1.353
28	Au₅₄Ne	vasp	0.000	-165.084	0.011	2654.442	-0.015
29	Au₅₄Na	vasp	0.000	-167.438	0.011	2654.442	-5.551
30	Au₅₄Mg	vasp	0.000	-166.817	0.012	2654.442	-3.232
31	AlAu₅₄	vasp	0.000	-168.662	0.012	2654.442	-1.327
32	Au₅₄Si	vasp	0.000	-169.936	0.012	2654.442	-0.547
33	Au₅₄P	vasp	0.000	-170.059	0.011	2654.442	0.123
34	Au₅₄S	vasp	0.000	-169.436	0.011	2654.442	0.877
35	Au₅₄Cl	vasp	0.000	-168.055	0.011	2654.442	0.954
36	Au₅₄Ar	vasp	0.000	-165.093	0.011	2654.442	-0.099
37	Au₅₄H	vasp	0.000	-168.134	0.011	2654.442	0.155
38	Au₅₄He	vasp	0.000	-165.067	0.011	2654.442	-0.015
39	Au₅₄Li	vasp	0.000	-167.627	0.011	2654.442	-5.047
40	Au₅₄Be	vasp	0.000	-166.735	0.011	2654.442	-1.560
41	Au₅₄B	vasp	0.000	-168.412	0.011	2654.442	0.021
42	Au₅₄C	vasp	0.000	-169.007	0.011	2654.442	0.691
43	Au₅₄N	vasp	0.000	-168.955	0.011	2654.442	1.558
44	Au₅₄O	vasp	0.000	-168.874	0.010	2654.442	2.393
45	Au₅₄F	vasp	0.000	-168.510	0.010	2654.442	2.726
46	Au₅₄Ne	vasp	0.000	-165.081	0.011	2654.442	-0.019
47	Au₅₄Na	vasp	0.000	-167.240	0.011	2654.442	-6.299
48	Au₅₄Mg	vasp	0.000	-166.341	0.011	2654.442	-3.297
49	AlAu₅₄	vasp	0.000	-168.104	0.011	2654.442	-2.036
50	Au₅₄Si	vasp	0.000	-168.778	0.011	2654.442	-1.163

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