ASE database

Displaying rows 1-8 out of 8
↓ ID ✕ Formula ✕ no_equ_2 ✕ no_equ_5 ✕ no_equ_23 ✕ plane_index ✕ no_equ_8 ✕ Charge ✕ no_equ_6 ✕
1 Cu54Li ratio:0.93,dipole:-1.125,distance:1.042,ads_E:-1.567 ratio:1.03,dipole:-2.924,distance:2.235,ads_E:-2.040 - 100 ratio:1.13,dipole:-3.714,distance:3.427,ads_E:-0.940 0.000 ratio:1.06,dipole:-3.520,distance:2.592,ads_E:-1.776
2 BeCu54 ratio:0.93,dipole:0.340153,distance:0.19957,ads_E:-2.58415 ratio:1.03,dipole:-0.173906,distance:1.30562,ads_E:-2.87935 - 100 ratio:1.13,dipole:-0.472991,distance:2.41168,ads_E:-1.3327 0.000 ratio:1.06,dipole:-0.280091,distance:1.63744,ads_E:-2.62506
3 Cu54B ratio:0.930,dipole:0.209,distance:-0.381,ads_E:-5.180 ratio:1.030,dipole:0.635,distance:0.668,ads_E:-5.579 - 100 ratio:1.130,dipole:0.870,distance:1.717,ads_E:-4.122 0.000 ratio:1.060,dipole:0.683,distance:0.983,ads_E:-5.361
4 Cu54C ratio:0.93,dipole:0.104359,distance:-0.462661,ads_E:-5.77067 ratio:1.03,dipole:0.653681,distance:0.578516,ads_E:-6.33223 - 100 ratio:1.13,dipole:1.19768,distance:1.61969,ads_E:-4.67472 0.000 ratio:1.06,dipole:0.76872,distance:0.890869,ads_E:-6.06915
5 Cu54N ratio:0.93,dipole:-0.001,distance:-0.350,ads_E:-4.156 ratio:1.03,dipole:0.566,distance:0.701,ads_E:-4.655 - 100 ratio:1.13,dipole:1.347,distance:1.752,ads_E:-2.917 0.000 ratio:1.06,dipole:0.760,distance:1.016,ads_E:-4.404
6 Cu54O ratio:0.930,dipole:-0.058,distance:0.015,ads_E:-4.909 ratio:1.030,dipole:0.754,distance:1.104,ads_E:-5.283 - 100 ratio:1.130,dipole:1.922,distance:2.193,ads_E:-2.973 0.000 ratio:1.060,dipole:1.037,distance:1.431,ads_E:-4.883
7 Cu54F ratio:0.930,dipole:0.015,distance:0.447,ads_E:-3.637 ratio:1.030,dipole:1.159,distance:1.579,ads_E:-4.212 - 100 ratio:1.130,dipole:4.250,distance:2.711,ads_E:-2.537 0.000 ratio:1.060,dipole:1.787,distance:1.918,ads_E:-3.859
8 Cu54Ar ratio:0.92,dipole:-0.596,distance:2.460,ads_E:0.278 ratio:0.98,dipole:-0.177,distance:3.274,ads_E:0.014 ratio:1.34,dipole:0.001,distance:8.158,ads_E:-0.005 100 ratio:1.04,dipole:-0.018,distance:4.088,ads_E:-0.017 0.000 ratio:1,dipole:-0.100,distance:3.545,ads_E:-0.007