ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	Maximum stress ✕	no_equ_22 ✕	Charge ✕	no_equ_16 ✕	plane_index ✕	Number of atoms ✕
1	Cu₅₄Li	0.009	-	0.000	ratio:1.9,dipole:-3.128,distance:12.609,ads_E:-0.058	100	55
2	BeCu₅₄	0.008	-	0.000	ratio:1.5,dipole:-0.0113499,distance:6.50408,ads_E:-0.00416696	100	55
3	Cu₅₄B	0.008	-	0.000	ratio:2.000,dipole:-1.008,distance:10.843,ads_E:-0.007	100	55
4	Cu₅₄C	0.008	-	0.000	ratio:1.51,dipole:2.9677,distance:5.57616,ads_E:-0.10513	100	55
5	Cu₅₄N	0.007	-	0.000	ratio:1.45,dipole:0.007,distance:5.116,ads_E:-0.007	100	55
6	Cu₅₄O	0.009	-	0.000	ratio:2.100,dipole:4.187,distance:12.753,ads_E:-0.168	100	55
7	Cu₅₄F	0.009	-	0.000	-	100	55
8	Cu₅₄Ar	0.009	ratio:1.32,dipole:0.002,distance:7.887,ads_E:-0.005	0.000	ratio:1.2,dipole:0.005,distance:6.259,ads_E:-0.006	100	55