ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	Charge ✕	Maximum stress ✕	ads_E ✕	no_equ_27 ✕	no_equ_25 ✕	no_equ_15 ✕
1	Cu₅₄Li	0.000	0.009	-2.222	-	-	ratio:1.7,dipole:-2.867,distance:10.224,ads_E:-0.066
2	BeCu₅₄	0.000	0.008	-2.934	-	-	ratio:1.45,dipole:-0.0224294,distance:5.95106,ads_E:-0.00714774
3	Cu₅₄B	0.000	0.008	-5.472	-	-	ratio:1.900,dipole:-0.558,distance:9.794,ads_E:-0.180
4	Cu₅₄C	0.000	0.008	-6.254	-	-	ratio:1.45,dipole:2.19263,distance:4.95146,ads_E:-0.182345
5	Cu₅₄N	0.000	0.007	-4.599	-	-	ratio:1.4,dipole:-0.095,distance:4.680,ads_E:-0.016
6	Cu₅₄O	0.000	0.009	-5.385	-	-	ratio:1.900,dipole:6.642,distance:10.576,ads_E:-0.174
7	Cu₅₄F	0.000	0.009	-4.264	-	-	ratio:1.900,dipole:13.468,distance:11.427,ads_E:-0.666
8	Cu₅₄Ar	0.000	0.009	0.020	ratio:1.42,dipole:0.000,distance:9.243,ads_E:-0.005	ratio:1.38,dipole:0.000,distance:8.701,ads_E:-0.005	ratio:1.18,dipole:0.006,distance:5.987,ads_E:-0.007