ASE database

Displaying rows 501-31 out of 31

Formula ✕	atom_E ✕	distance ✕	Energy ✕	Dipole_val ✕	ads_E ✕
Cu₇₂P	-1.888	0.877	-258.140	0.631	-4.158
Cu₇₂S	-0.945	0.983	-257.602	0.628	-4.563
Cu₇₂Cl	-0.243	1.583	-255.817	1.060	-3.480
Cu₇₂Ar	-0.025	3.561	-252.163	-0.061	-0.043
Cu₇₂H	-1.117	1.515	-255.116	0.728	-1.905
Cu₇₂He	0.002	3.582	-252.122	-0.030	-0.029
Cu₇₂Li	-0.299	2.095	-254.178	-4.654	-1.785
BeCu₇₂	-0.039	1.719	-253.474	-0.984	-1.340
Cu₇₂B	-0.349	1.699	-255.137	0.649	-2.695
Cu₇₂C	-1.248	1.526	-256.266	1.506	-2.924
Cu₇₂N	-3.124	1.504	-256.842	2.125	-1.624
Cu₇₂O	-1.533	1.636	-257.085	2.704	-3.458
Cu₇₂F	-0.424	1.828	-256.591	2.758	-4.073
Cu₇₂Ne	-0.013	3.441	-252.138	-0.029	-0.032
Cu₇₂Na	-0.225	2.422	-253.859	-5.698	-1.541
Cu₇₂Mg	-0.004	2.196	-253.063	-2.721	-0.965
AlCu₇₂	-0.295	2.110	-254.732	-1.130	-2.343
Cu₇₂Si	-0.830	1.718	-255.804	0.302	-2.880
Cu₇₂P	-1.888	1.495	-256.307	1.317	-2.325
Cu₇₂S	-0.945	1.748	-256.293	2.164	-3.255
Cu₇₂Cl	-0.243	2.147	-255.574	2.539	-3.237
Cu₇₂Ar	-0.025	3.547	-252.148	-0.149	-0.028
Cu₅₄H	-1.120	0.915	-196.524	0.013	-2.559
Cu₅₄He	0.002	3.701	-192.846	-0.021	-0.002
Cu₅₄Li	-0.299	2.029	-195.478	-3.352	-2.334