ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	no_equ_5 ✕	str_E ✕	no_equ_4 ✕	no_equ_21 ✕
1	Cu₅₄Li	ratio:1.03,dipole:-2.924,distance:2.235,ads_E:-2.040	-193.113	ratio:1,dipole:-2.353,distance:1.877,ads_E:-2.141	-
2	BeCu₅₄	ratio:1.03,dipole:-0.173906,distance:1.30562,ads_E:-2.87935	-193.566	ratio:1,dipole:0.00345513,distance:0.973808,ads_E:-2.95616	-
3	Cu₅₄B	ratio:1.030,dipole:0.635,distance:0.668,ads_E:-5.579	-196.413	ratio:1.000,dipole:0.557,distance:0.353,ads_E:-5.662	-
4	Cu₅₄C	ratio:1.03,dipole:0.653681,distance:0.578516,ads_E:-6.33223	-198.094	ratio:1,dipole:0.52283,distance:0.266163,ads_E:-6.42427	ratio:2.2,dipole:7.59718,distance:12.7603,ads_E:-0.0579928
5	Cu₅₄N	ratio:1.03,dipole:0.566,distance:0.701,ads_E:-4.655	-198.315	ratio:1,dipole:0.368,distance:0.386,ads_E:-4.725	-
6	Cu₅₄O	ratio:1.030,dipole:0.754,distance:1.104,ads_E:-5.283	-197.510	ratio:1.000,dipole:0.486,distance:0.778,ads_E:-5.406	-
7	Cu₅₄F	ratio:1.030,dipole:1.159,distance:1.579,ads_E:-4.212	-195.280	ratio:1.000,dipole:0.693,distance:1.239,ads_E:-4.335	-
8	Cu₅₄Ar	ratio:0.98,dipole:-0.177,distance:3.274,ads_E:0.014	-190.598	ratio:0.96,dipole:-0.291,distance:3.002,ads_E:0.057	ratio:1.3,dipole:0.002,distance:7.615,ads_E:-0.005