ASE database

Displaying rows 1-25 out of 594

↓ ID ✕	Formula ✕	Mass ✕	no_equ_12 ✕	no_equ_3 ✕
1	Cu₅₄Li	3438.424	ratio:1.3,dipole:-2.555,distance:5.454,ads_E:-0.165	ratio:0.96,dipole:-1.624,distance:1.400,ads_E:-1.949
2	BeCu₅₄	3440.496	ratio:1.3,dipole:-0.18803,distance:4.29197,ads_E:-0.0630632	ratio:0.96,dipole:0.234375,distance:0.531386,ads_E:-2.83237
3	Cu₅₄B	3442.294	ratio:1.350,dipole:-0.748,distance:4.025,ads_E:-0.303	ratio:0.960,dipole:0.398,distance:-0.066,ads_E:-5.490
4	Cu₅₄C	3443.495	ratio:1.3,dipole:2.30687,distance:3.38969,ads_E:-0.486531	ratio:0.96,dipole:0.291413,distance:-0.150308,ads_E:-6.20762
5	Cu₅₄N	3445.491	ratio:1.3,dipole:0.575,distance:3.539,ads_E:-0.068	ratio:0.96,dipole:0.160,distance:-0.035,ads_E:-4.570
6	Cu₅₄O	3447.483	ratio:1.310,dipole:3.768,distance:4.152,ads_E:-0.372	ratio:0.960,dipole:0.131,distance:0.342,ads_E:-5.226
7	Cu₅₄F	3450.482	ratio:1.450,dipole:8.949,distance:6.333,ads_E:-0.889	ratio:0.960,dipole:0.260,distance:0.787,ads_E:-4.090
8	Cu₅₄Ar	3471.432	ratio:1.12,dipole:0.009,distance:5.173,ads_E:-0.010	ratio:0.94,dipole:-0.431,distance:2.731,ads_E:0.139

1
2
3
4
5
...
21
22
23
24