ASE database

Displaying rows 576-594 out of 594

Formula ✕	ads_site ✕	slab_E ✕	Number of atoms ✕	PBC ✕	str_E ✕	Calculator ✕	Age ✕	Maximum force ✕
Cu₅₄Ar	1b	-192.845	55	TTT	-192.880	vasp	15M	0.012
Cu₅₄H	0t	-192.845	55	TTT	-195.885	vasp	15M	0.006
Cu₅₄He	0t	-192.845	55	TTT	-192.846	vasp	15M	0.009
Cu₅₄Li	0t	-192.845	55	TTT	-195.366	vasp	15M	0.008
BeCu₅₄	0t	-192.845	55	TTT	-194.841	vasp	15M	0.008
Cu₅₄B	0t	-192.845	55	TTT	-196.257	vasp	15M	0.011
Cu₅₄C	0t	-192.845	55	TTT	-197.311	vasp	15M	0.009
Cu₅₄N	0t	-192.845	55	TTT	-197.708	vasp	15M	0.479
Cu₅₄O	0t	-192.845	55	TTT	-197.707	vasp	15M	0.007
Cu₅₄F	0t	-192.845	55	TTT	-197.040	vasp	15M	0.010
Cu₅₄Ne	0t	-192.845	55	TTT	-192.865	vasp	15M	0.009
Cu₅₄Na	0t	-192.845	55	TTT	-194.968	vasp	15M	0.009
Cu₅₄Mg	0t	-192.845	55	TTT	-194.352	vasp	15M	0.008
AlCu₅₄	0t	-192.845	55	TTT	-195.938	vasp	15M	0.007
Cu₅₄Si	0t	-192.845	55	TTT	-197.142	vasp	15M	0.008
Cu₅₄P	0t	-192.845	55	TTT	-197.546	vasp	15M	0.008
Cu₅₄S	0t	-192.845	55	TTT	-197.153	vasp	15M	0.009
Cu₅₄Cl	0t	-192.845	55	TTT	-196.079	vasp	15M	0.008
Cu₅₄Ar	0t	-192.845	55	TTT	-192.878	vasp	15M	0.010

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