ASE database

Displaying rows 526-8 out of 8

↓ ID ✕	Formula ✕	Dipole_val ✕	Calculator ✕	PBC ✕	ads_site ✕	Age ✕	Mass ✕
526	BeCu₅₄	-0.793	vasp	TTT	2h	15M	3440.496
527	Cu₅₄B	0.375	vasp	TTT	2h	15M	3442.294
528	Cu₅₄C	0.645	vasp	TTT	2h	15M	3443.495
529	Cu₅₄N	0.716	vasp	TTT	2h	15M	3445.491
530	Cu₅₄O	0.779	vasp	TTT	2h	15M	3447.483
531	Cu₅₄F	0.691	vasp	TTT	2h	15M	3450.482
532	Cu₅₄Ne	-0.008	vasp	TTT	2h	15M	3451.664
533	Cu₅₄Na	-4.509	vasp	TTT	2h	15M	3454.474
534	Cu₅₄Mg	-2.586	vasp	TTT	2h	15M	3455.789
535	AlCu₅₄	-0.999	vasp	TTT	2h	15M	3458.466
536	Cu₅₄Si	0.033	vasp	TTT	2h	15M	3459.569
537	Cu₅₄P	0.599	vasp	TTT	2h	15M	3462.458
538	Cu₅₄S	0.730	vasp	TTT	2h	15M	3463.544
539	Cu₅₄Cl	0.342	vasp	TTT	2h	15M	3466.934
540	Cu₅₄Ar	-0.060	vasp	TTT	2h	15M	3471.432
541	Cu₅₄H	0.018	vasp	TTT	3h	15M	3432.492
542	Cu₅₄He	-0.018	vasp	TTT	3h	15M	3435.487
543	Cu₅₄Li	-3.363	vasp	TTT	3h	15M	3438.424
544	BeCu₅₄	-0.802	vasp	TTT	3h	15M	3440.496
545	Cu₅₄B	0.352	vasp	TTT	3h	15M	3442.294
546	Cu₅₄C	0.620	vasp	TTT	3h	15M	3443.495
547	Cu₅₄N	0.718	vasp	TTT	3h	15M	3445.491
548	Cu₅₄O	0.820	vasp	TTT	3h	15M	3447.483
549	Cu₅₄F	0.747	vasp	TTT	3h	15M	3450.482
550	Cu₅₄Ne	-0.010	vasp	TTT	3h	15M	3451.664