ASE database

Displaying rows 1-25 out of 31

↓ ID ✕	Formula ✕	Username ✕	no_equ_6 ✕	Charge ✕	Magnetic moment ✕	Mass ✕
1	Cu₅₄Li	hecc	ratio:1.06,dipole:-3.520,distance:2.592,ads_E:-1.776	0.000	0.000	3438.424
2	BeCu₅₄	hecc	ratio:1.06,dipole:-0.280091,distance:1.63744,ads_E:-2.62506	0.000	-0.000	3440.496
3	Cu₅₄B	hecc	ratio:1.060,dipole:0.683,distance:0.983,ads_E:-5.361	0.000	0.000	3442.294
4	Cu₅₄C	hecc	ratio:1.06,dipole:0.76872,distance:0.890869,ads_E:-6.06915	0.000	-0.000	3443.495
5	Cu₅₄N	hecc	ratio:1.06,dipole:0.760,distance:1.016,ads_E:-4.404	0.000	-0.000	3445.491
6	Cu₅₄O	hecc	ratio:1.060,dipole:1.037,distance:1.431,ads_E:-4.883	0.000	0.000	3447.483
7	Cu₅₄F	hecc	ratio:1.060,dipole:1.787,distance:1.918,ads_E:-3.859	0.000	-0.000	3450.482
8	Cu₅₄Ar	hecc	ratio:1,dipole:-0.100,distance:3.545,ads_E:-0.007	0.000	-0.000	3471.432