ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	no_equ_11 ✕	Maximum force ✕	no_equ_20 ✕
1	Cu₅₄Li	ratio:1.25,dipole:-2.667,distance:4.858,ads_E:-0.244	0.009	-
2	BeCu₅₄	ratio:1.25,dipole:-0.291055,distance:3.73895,ads_E:-0.152313	0.010	-
3	Cu₅₄B	ratio:1.250,dipole:-0.107,distance:2.976,ads_E:-0.989	0.005	-
4	Cu₅₄C	ratio:1.25,dipole:1.94527,distance:2.86911,ads_E:-0.945693	0.010	ratio:2.1,dipole:5.51535,distance:11.7191,ads_E:-0.0591715
5	Cu₅₄N	ratio:1.25,dipole:0.908,distance:3.014,ads_E:-0.162	0.005	-
6	Cu₅₄O	ratio:1.250,dipole:3.446,distance:3.499,ads_E:-0.537	0.008	-
7	Cu₅₄F	ratio:1.300,dipole:7.369,distance:4.635,ads_E:-1.125	0.006	-
8	Cu₅₄Ar	ratio:1.1,dipole:0.008,distance:4.902,ads_E:-0.012	0.007	ratio:1.28,dipole:0.001,distance:7.344,ads_E:-0.005