ASE database

Displaying rows 1-25 out of 594

↓ ID ✕	Formula ✕	no_equ_17 ✕	Number of atoms ✕	Magnetic moment ✕	no_equ_6 ✕	no_equ_22 ✕	no_equ_20 ✕
1	Cu₅₄Li	-	55	0.000	ratio:1.06,dipole:-3.520,distance:2.592,ads_E:-1.776	-	-
2	BeCu₅₄	ratio:1.55,dipole:-0.00631543,distance:7.10066,ads_E:-0.00261613	55	-0.000	ratio:1.06,dipole:-0.280091,distance:1.63744,ads_E:-2.62506	-	-
3	Cu₅₄B	ratio:2.100,dipole:-0.833,distance:11.891,ads_E:-0.007	55	0.000	ratio:1.060,dipole:0.683,distance:0.983,ads_E:-5.361	-	-
4	Cu₅₄C	ratio:1.55,dipole:3.07149,distance:5.99264,ads_E:-0.095025	55	-0.000	ratio:1.06,dipole:0.76872,distance:0.890869,ads_E:-6.06915	-	ratio:2.1,dipole:5.51535,distance:11.7191,ads_E:-0.0591715
5	Cu₅₄N	ratio:1.5,dipole:0.030,distance:5.736,ads_E:-0.004	55	-0.000	ratio:1.06,dipole:0.760,distance:1.016,ads_E:-4.404	-	-
6	Cu₅₄O	-	55	0.000	ratio:1.060,dipole:1.037,distance:1.431,ads_E:-4.883	-	-
7	Cu₅₄F	-	55	-0.000	ratio:1.060,dipole:1.787,distance:1.918,ads_E:-3.859	-	-
8	Cu₅₄Ar	ratio:1.22,dipole:0.004,distance:6.530,ads_E:-0.006	55	-0.000	ratio:1,dipole:-0.100,distance:3.545,ads_E:-0.007	ratio:1.32,dipole:0.002,distance:7.887,ads_E:-0.005	ratio:1.28,dipole:0.001,distance:7.344,ads_E:-0.005

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