ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	no_equ_5 ✕	no_equ_11 ✕
1	Cu₅₄Li	ratio:1.03,dipole:-2.924,distance:2.235,ads_E:-2.040	ratio:1.25,dipole:-2.667,distance:4.858,ads_E:-0.244
2	BeCu₅₄	ratio:1.03,dipole:-0.173906,distance:1.30562,ads_E:-2.87935	ratio:1.25,dipole:-0.291055,distance:3.73895,ads_E:-0.152313
3	Cu₅₄B	ratio:1.030,dipole:0.635,distance:0.668,ads_E:-5.579	ratio:1.250,dipole:-0.107,distance:2.976,ads_E:-0.989
4	Cu₅₄C	ratio:1.03,dipole:0.653681,distance:0.578516,ads_E:-6.33223	ratio:1.25,dipole:1.94527,distance:2.86911,ads_E:-0.945693
5	Cu₅₄N	ratio:1.03,dipole:0.566,distance:0.701,ads_E:-4.655	ratio:1.25,dipole:0.908,distance:3.014,ads_E:-0.162
6	Cu₅₄O	ratio:1.030,dipole:0.754,distance:1.104,ads_E:-5.283	ratio:1.250,dipole:3.446,distance:3.499,ads_E:-0.537
7	Cu₅₄F	ratio:1.030,dipole:1.159,distance:1.579,ads_E:-4.212	ratio:1.300,dipole:7.369,distance:4.635,ads_E:-1.125
8	Cu₅₄Ar	ratio:0.98,dipole:-0.177,distance:3.274,ads_E:0.014	ratio:1.1,dipole:0.008,distance:4.902,ads_E:-0.012