ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	distance ✕	no_equ_9 ✕	no_equ_16 ✕	slab_E ✕
1	Cu₅₄Li	1.865	ratio:1.15,dipole:-3.511,distance:3.666,ads_E:-0.744	ratio:1.9,dipole:-3.128,distance:12.609,ads_E:-0.058	-190.592
2	BeCu₅₄	1.012	ratio:1.16,dipole:-0.39644,distance:2.7435,ads_E:-0.772653	ratio:1.5,dipole:-0.0113499,distance:6.50408,ads_E:-0.00416696	-190.592
3	Cu₅₄B	0.409	ratio:1.160,dipole:0.981,distance:2.032,ads_E:-3.278	ratio:2.000,dipole:-1.008,distance:10.843,ads_E:-0.007	-190.592
4	Cu₅₄C	0.260	ratio:1.16,dipole:1.37647,distance:1.93205,ads_E:-3.75037	ratio:1.51,dipole:2.9677,distance:5.57616,ads_E:-0.10513	-190.592
5	Cu₅₄N	0.399	ratio:1.16,dipole:1.554,distance:2.068,ads_E:-1.933	ratio:1.45,dipole:0.007,distance:5.116,ads_E:-0.007	-190.592
6	Cu₅₄O	0.772	ratio:1.160,dipole:2.453,distance:2.519,ads_E:-1.842	ratio:2.100,dipole:4.187,distance:12.753,ads_E:-0.168	-190.592
7	Cu₅₄F	1.238	ratio:1.160,dipole:5.403,distance:3.050,ads_E:-2.006	-	-190.592
8	Cu₅₄Ar	3.861	ratio:1.06,dipole:-0.003,distance:4.359,ads_E:-0.016	ratio:1.2,dipole:0.005,distance:6.259,ads_E:-0.006	-190.592