ASE database

Displaying rows 501-8 out of 8

↓ ID ✕	Formula ✕	Maximum stress ✕	atom_E ✕	Magnetic moment ✕	Calculator ✕	Energy ✕	str_E ✕	distance ✕
501	Cu₇₂P	0.009	-1.888	0.000	vasp	-258.140	-258.140	0.877
502	Cu₇₂S	0.008	-0.945	0.000	vasp	-257.602	-257.602	0.983
503	Cu₇₂Cl	0.009	-0.243	0.000	vasp	-255.817	-255.817	1.583
504	Cu₇₂Ar	0.009	-0.025	0.000	vasp	-252.163	-252.163	3.561
505	Cu₇₂H	0.009	-1.117	-0.000	vasp	-255.116	-255.116	1.515
506	Cu₇₂He	0.010	0.002	0.000	vasp	-252.122	-252.122	3.582
507	Cu₇₂Li	0.010	-0.299	-0.000	vasp	-254.178	-254.178	2.095
508	BeCu₇₂	0.009	-0.039	-0.000	vasp	-253.474	-253.474	1.719
509	Cu₇₂B	0.010	-0.349	-0.000	vasp	-255.137	-255.137	1.699
510	Cu₇₂C	0.010	-1.248	-0.000	vasp	-256.266	-256.266	1.526
511	Cu₇₂N	0.010	-3.124	-0.006	vasp	-256.842	-256.842	1.504
512	Cu₇₂O	0.009	-1.533	0.000	vasp	-257.085	-257.085	1.636
513	Cu₇₂F	0.009	-0.424	0.000	vasp	-256.591	-256.591	1.828
514	Cu₇₂Ne	0.010	-0.013	-0.000	vasp	-252.138	-252.138	3.441
515	Cu₇₂Na	0.010	-0.225	-0.000	vasp	-253.859	-253.859	2.422
516	Cu₇₂Mg	0.009	-0.004	-0.000	vasp	-253.063	-253.063	2.196
517	AlCu₇₂	0.010	-0.295	-0.000	vasp	-254.732	-254.732	2.110
518	Cu₇₂Si	0.010	-0.830	-0.000	vasp	-255.804	-255.804	1.718
519	Cu₇₂P	0.010	-1.888	-0.000	vasp	-256.307	-256.307	1.495
520	Cu₇₂S	0.009	-0.945	-0.000	vasp	-256.293	-256.293	1.748
521	Cu₇₂Cl	0.009	-0.243	-0.000	vasp	-255.574	-255.574	2.147
522	Cu₇₂Ar	0.010	-0.025	0.000	vasp	-252.148	-252.148	3.547
523	Cu₅₄H	0.007	-1.120	-0.000	vasp	-196.524	-196.524	0.915
524	Cu₅₄He	0.007	0.002	-0.000	vasp	-192.846	-192.846	3.701
525	Cu₅₄Li	0.008	-0.299	0.000	vasp	-195.478	-195.478	2.029