ASE database

Displaying rows 1-25 out of 31

Formula ✕	no_equ_7 ✕	Magnetic moment ✕	no_equ_30 ✕	no_equ_13 ✕
Cu₅₄Li	ratio:1.1,dipole:-4.039,distance:3.069,ads_E:-1.290	0.000	-	ratio:1.35,dipole:-2.533,distance:6.051,ads_E:-0.126
BeCu₅₄	ratio:1.1,dipole:-0.434967,distance:2.07986,ads_E:-1.97799	-0.000	-	ratio:1.35,dipole:-0.0991408,distance:4.845,ads_E:-0.0276465
Cu₅₄B	ratio:1.100,dipole:0.778,distance:1.402,ads_E:-4.794	0.000	-	ratio:1.400,dipole:-0.694,distance:4.626,ads_E:-0.236
Cu₅₄C	ratio:1.1,dipole:1.00519,distance:1.30734,ads_E:-5.4061	-0.000	-	ratio:1.35,dipole:2.50975,distance:3.91028,ads_E:-0.271632
Cu₅₄N	ratio:1.1,dipole:1.088,distance:1.437,ads_E:-3.705	-0.000	-	ratio:1.33,dipole:0.416,distance:3.855,ads_E:-0.042
Cu₅₄O	ratio:1.100,dipole:1.502,distance:1.866,ads_E:-3.941	0.000	-	ratio:1.350,dipole:3.982,distance:4.588,ads_E:-0.321
Cu₅₄F	ratio:1.100,dipole:3.086,distance:2.371,ads_E:-3.138	-0.000	-	ratio:1.550,dipole:9.933,distance:7.465,ads_E:-0.801
Cu₅₄Ar	ratio:1.02,dipole:-0.049,distance:3.817,ads_E:-0.015	-0.000	ratio:1.48,dipole:0.000,distance:10.057,ads_E:-0.005	ratio:1.14,dipole:0.008,distance:5.445,ads_E:-0.009