ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	no_equ_8 ✕	no_equ_19 ✕	no_equ_2 ✕
1	Cu₅₄Li	ratio:1.13,dipole:-3.714,distance:3.427,ads_E:-0.940	-	ratio:0.93,dipole:-1.125,distance:1.042,ads_E:-1.567
2	BeCu₅₄	ratio:1.13,dipole:-0.472991,distance:2.41168,ads_E:-1.3327	-	ratio:0.93,dipole:0.340153,distance:0.19957,ads_E:-2.58415
3	Cu₅₄B	ratio:1.130,dipole:0.870,distance:1.717,ads_E:-4.122	-	ratio:0.930,dipole:0.209,distance:-0.381,ads_E:-5.180
4	Cu₅₄C	ratio:1.13,dipole:1.19768,distance:1.61969,ads_E:-4.67472	ratio:1.8,dipole:3.74248,distance:8.59558,ads_E:-0.0684837	ratio:0.93,dipole:0.104359,distance:-0.462661,ads_E:-5.77067
5	Cu₅₄N	ratio:1.13,dipole:1.347,distance:1.752,ads_E:-2.917	ratio:1.6,dipole:0.009,distance:6.693,ads_E:-0.002	ratio:0.93,dipole:-0.001,distance:-0.350,ads_E:-4.156
6	Cu₅₄O	ratio:1.130,dipole:1.922,distance:2.193,ads_E:-2.973	-	ratio:0.930,dipole:-0.058,distance:0.015,ads_E:-4.909
7	Cu₅₄F	ratio:1.130,dipole:4.250,distance:2.711,ads_E:-2.537	-	ratio:0.930,dipole:0.015,distance:0.447,ads_E:-3.637
8	Cu₅₄Ar	ratio:1.04,dipole:-0.018,distance:4.088,ads_E:-0.017	ratio:1.26,dipole:0.002,distance:7.073,ads_E:-0.005	ratio:0.92,dipole:-0.596,distance:2.460,ads_E:0.278