ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	no_equ_2 ✕	no_equ_29 ✕	no_equ_7 ✕
1	Cu₅₄Li	ratio:0.93,dipole:-1.125,distance:1.042,ads_E:-1.567	-	ratio:1.1,dipole:-4.039,distance:3.069,ads_E:-1.290
2	BeCu₅₄	ratio:0.93,dipole:0.340153,distance:0.19957,ads_E:-2.58415	-	ratio:1.1,dipole:-0.434967,distance:2.07986,ads_E:-1.97799
3	Cu₅₄B	ratio:0.930,dipole:0.209,distance:-0.381,ads_E:-5.180	-	ratio:1.100,dipole:0.778,distance:1.402,ads_E:-4.794
4	Cu₅₄C	ratio:0.93,dipole:0.104359,distance:-0.462661,ads_E:-5.77067	-	ratio:1.1,dipole:1.00519,distance:1.30734,ads_E:-5.4061
5	Cu₅₄N	ratio:0.93,dipole:-0.001,distance:-0.350,ads_E:-4.156	-	ratio:1.1,dipole:1.088,distance:1.437,ads_E:-3.705
6	Cu₅₄O	ratio:0.930,dipole:-0.058,distance:0.015,ads_E:-4.909	-	ratio:1.100,dipole:1.502,distance:1.866,ads_E:-3.941
7	Cu₅₄F	ratio:0.930,dipole:0.015,distance:0.447,ads_E:-3.637	-	ratio:1.100,dipole:3.086,distance:2.371,ads_E:-3.138
8	Cu₅₄Ar	ratio:0.92,dipole:-0.596,distance:2.460,ads_E:0.278	ratio:1.46,dipole:0.000,distance:9.786,ads_E:-0.005	ratio:1.02,dipole:-0.049,distance:3.817,ads_E:-0.015