ASE database

Displaying rows 1-8 out of 8

Formula ✕	no_equ_16 ✕	Dipole_val ✕	no_equ_25 ✕	no_equ_22 ✕	no_equ_5 ✕
Cu₅₄Li	ratio:1.9,dipole:-3.128,distance:12.609,ads_E:-0.058	-2.989	-	-	ratio:1.03,dipole:-2.924,distance:2.235,ads_E:-2.040
BeCu₅₄	ratio:1.5,dipole:-0.0113499,distance:6.50408,ads_E:-0.00416696	-0.069	-	-	ratio:1.03,dipole:-0.173906,distance:1.30562,ads_E:-2.87935
Cu₅₄B	ratio:2.000,dipole:-1.008,distance:10.843,ads_E:-0.007	0.558	-	-	ratio:1.030,dipole:0.635,distance:0.668,ads_E:-5.579
Cu₅₄C	ratio:1.51,dipole:2.9677,distance:5.57616,ads_E:-0.10513	0.431	-	-	ratio:1.03,dipole:0.653681,distance:0.578516,ads_E:-6.33223
Cu₅₄N	ratio:1.45,dipole:0.007,distance:5.116,ads_E:-0.007	0.356	-	-	ratio:1.03,dipole:0.566,distance:0.701,ads_E:-4.655
Cu₅₄O	ratio:2.100,dipole:4.187,distance:12.753,ads_E:-0.168	0.473	-	-	ratio:1.030,dipole:0.754,distance:1.104,ads_E:-5.283
Cu₅₄F	-	0.677	-	-	ratio:1.030,dipole:1.159,distance:1.579,ads_E:-4.212
Cu₅₄Ar	ratio:1.2,dipole:0.005,distance:6.259,ads_E:-0.006	-0.049	ratio:1.38,dipole:0.000,distance:8.701,ads_E:-0.005	ratio:1.32,dipole:0.002,distance:7.887,ads_E:-0.005	ratio:0.98,dipole:-0.177,distance:3.274,ads_E:0.014