ASE database

Displaying rows 1-25 out of 594

↓ ID ✕	Formula ✕	Number of atoms ✕	no_equ_10 ✕	no_equ_20 ✕
1	Cu₅₄Li	55	ratio:1.17,dipole:-3.222,distance:3.904,ads_E:-0.582	-
2	BeCu₅₄	55	ratio:1.2,dipole:-0.359907,distance:3.18592,ads_E:-0.372501	-
3	Cu₅₄B	55	ratio:1.200,dipole:0.935,distance:2.451,ads_E:-2.045	-
4	Cu₅₄C	55	ratio:1.2,dipole:1.54212,distance:2.34852,ads_E:-2.29339	ratio:2.1,dipole:5.51535,distance:11.7191,ads_E:-0.0591715
5	Cu₅₄N	55	ratio:1.2,dipole:1.380,distance:2.488,ads_E:-0.433	-
6	Cu₅₄O	55	ratio:1.200,dipole:3.021,distance:2.955,ads_E:-0.945	-
7	Cu₅₄F	55	ratio:1.250,dipole:6.761,distance:4.069,ads_E:-1.287	-
8	Cu₅₄Ar	55	ratio:1.08,dipole:0.005,distance:4.631,ads_E:-0.014	ratio:1.28,dipole:0.001,distance:7.344,ads_E:-0.005

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