ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	no_equ_2 ✕	no_equ_4 ✕	atom_E ✕
1	Cu₅₄Li	ratio:0.93,dipole:-1.125,distance:1.042,ads_E:-1.567	ratio:1,dipole:-2.353,distance:1.877,ads_E:-2.141	-0.299
2	BeCu₅₄	ratio:0.93,dipole:0.340153,distance:0.19957,ads_E:-2.58415	ratio:1,dipole:0.00345513,distance:0.973808,ads_E:-2.95616	-0.039
3	Cu₅₄B	ratio:0.930,dipole:0.209,distance:-0.381,ads_E:-5.180	ratio:1.000,dipole:0.557,distance:0.353,ads_E:-5.662	-0.349
4	Cu₅₄C	ratio:0.93,dipole:0.104359,distance:-0.462661,ads_E:-5.77067	ratio:1,dipole:0.52283,distance:0.266163,ads_E:-6.42427	-1.248
5	Cu₅₄N	ratio:0.93,dipole:-0.001,distance:-0.350,ads_E:-4.156	ratio:1,dipole:0.368,distance:0.386,ads_E:-4.725	-3.124
6	Cu₅₄O	ratio:0.930,dipole:-0.058,distance:0.015,ads_E:-4.909	ratio:1.000,dipole:0.486,distance:0.778,ads_E:-5.406	-1.533
7	Cu₅₄F	ratio:0.930,dipole:0.015,distance:0.447,ads_E:-3.637	ratio:1.000,dipole:0.693,distance:1.239,ads_E:-4.335	-0.424
8	Cu₅₄Ar	ratio:0.92,dipole:-0.596,distance:2.460,ads_E:0.278	ratio:0.96,dipole:-0.291,distance:3.002,ads_E:0.057	-0.025