ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	no_equ_30 ✕	no_equ_23 ✕	no_equ_8 ✕	no_equ_13 ✕
1	Cu₅₄Li	-	-	ratio:1.13,dipole:-3.714,distance:3.427,ads_E:-0.940	ratio:1.35,dipole:-2.533,distance:6.051,ads_E:-0.126
2	BeCu₅₄	-	-	ratio:1.13,dipole:-0.472991,distance:2.41168,ads_E:-1.3327	ratio:1.35,dipole:-0.0991408,distance:4.845,ads_E:-0.0276465
3	Cu₅₄B	-	-	ratio:1.130,dipole:0.870,distance:1.717,ads_E:-4.122	ratio:1.400,dipole:-0.694,distance:4.626,ads_E:-0.236
4	Cu₅₄C	-	-	ratio:1.13,dipole:1.19768,distance:1.61969,ads_E:-4.67472	ratio:1.35,dipole:2.50975,distance:3.91028,ads_E:-0.271632
5	Cu₅₄N	-	-	ratio:1.13,dipole:1.347,distance:1.752,ads_E:-2.917	ratio:1.33,dipole:0.416,distance:3.855,ads_E:-0.042
6	Cu₅₄O	-	-	ratio:1.130,dipole:1.922,distance:2.193,ads_E:-2.973	ratio:1.350,dipole:3.982,distance:4.588,ads_E:-0.321
7	Cu₅₄F	-	-	ratio:1.130,dipole:4.250,distance:2.711,ads_E:-2.537	ratio:1.550,dipole:9.933,distance:7.465,ads_E:-0.801
8	Cu₅₄Ar	ratio:1.48,dipole:0.000,distance:10.057,ads_E:-0.005	ratio:1.34,dipole:0.001,distance:8.158,ads_E:-0.005	ratio:1.04,dipole:-0.018,distance:4.088,ads_E:-0.017	ratio:1.14,dipole:0.008,distance:5.445,ads_E:-0.009