ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	no_equ_17 ✕	no_equ_12 ✕	no_equ_14 ✕
1	Cu₅₄Li	-	ratio:1.3,dipole:-2.555,distance:5.454,ads_E:-0.165	ratio:1.5,dipole:-2.645,distance:7.839,ads_E:-0.084
2	BeCu₅₄	ratio:1.55,dipole:-0.00631543,distance:7.10066,ads_E:-0.00261613	ratio:1.3,dipole:-0.18803,distance:4.29197,ads_E:-0.0630632	ratio:1.4,dipole:-0.047443,distance:5.39803,ads_E:-0.0134448
3	Cu₅₄B	ratio:2.100,dipole:-0.833,distance:11.891,ads_E:-0.007	ratio:1.350,dipole:-0.748,distance:4.025,ads_E:-0.303	ratio:1.500,dipole:-0.465,distance:5.598,ads_E:-0.193
4	Cu₅₄C	ratio:1.55,dipole:3.07149,distance:5.99264,ads_E:-0.095025	ratio:1.3,dipole:2.30687,distance:3.38969,ads_E:-0.486531	ratio:1.4,dipole:2.63066,distance:4.43087,ads_E:-0.175371
5	Cu₅₄N	ratio:1.5,dipole:0.030,distance:5.736,ads_E:-0.004	ratio:1.3,dipole:0.575,distance:3.539,ads_E:-0.068	ratio:1.36,dipole:-0.067,distance:4.254,ads_E:-0.030
6	Cu₅₄O	-	ratio:1.310,dipole:3.768,distance:4.152,ads_E:-0.372	ratio:1.550,dipole:3.996,distance:6.765,ads_E:-0.507
7	Cu₅₄F	-	ratio:1.450,dipole:8.949,distance:6.333,ads_E:-0.889	ratio:1.600,dipole:10.431,distance:8.031,ads_E:-0.769
8	Cu₅₄Ar	ratio:1.22,dipole:0.004,distance:6.530,ads_E:-0.006	ratio:1.12,dipole:0.009,distance:5.173,ads_E:-0.010	ratio:1.16,dipole:0.006,distance:5.716,ads_E:-0.008