ASE database

Displaying rows 1-8 out of 8
↓ ID ✕ Formula ✕ no_equ_13 ✕ plane_index ✕ no_equ_10 ✕ Username ✕ no_equ_8 ✕
1 Cu54Li ratio:1.35,dipole:-2.533,distance:6.051,ads_E:-0.126 100 ratio:1.17,dipole:-3.222,distance:3.904,ads_E:-0.582 hecc ratio:1.13,dipole:-3.714,distance:3.427,ads_E:-0.940
2 BeCu54 ratio:1.35,dipole:-0.0991408,distance:4.845,ads_E:-0.0276465 100 ratio:1.2,dipole:-0.359907,distance:3.18592,ads_E:-0.372501 hecc ratio:1.13,dipole:-0.472991,distance:2.41168,ads_E:-1.3327
3 Cu54B ratio:1.400,dipole:-0.694,distance:4.626,ads_E:-0.236 100 ratio:1.200,dipole:0.935,distance:2.451,ads_E:-2.045 hecc ratio:1.130,dipole:0.870,distance:1.717,ads_E:-4.122
4 Cu54C ratio:1.35,dipole:2.50975,distance:3.91028,ads_E:-0.271632 100 ratio:1.2,dipole:1.54212,distance:2.34852,ads_E:-2.29339 hecc ratio:1.13,dipole:1.19768,distance:1.61969,ads_E:-4.67472
5 Cu54N ratio:1.33,dipole:0.416,distance:3.855,ads_E:-0.042 100 ratio:1.2,dipole:1.380,distance:2.488,ads_E:-0.433 hecc ratio:1.13,dipole:1.347,distance:1.752,ads_E:-2.917
6 Cu54O ratio:1.350,dipole:3.982,distance:4.588,ads_E:-0.321 100 ratio:1.200,dipole:3.021,distance:2.955,ads_E:-0.945 hecc ratio:1.130,dipole:1.922,distance:2.193,ads_E:-2.973
7 Cu54F ratio:1.550,dipole:9.933,distance:7.465,ads_E:-0.801 100 ratio:1.250,dipole:6.761,distance:4.069,ads_E:-1.287 hecc ratio:1.130,dipole:4.250,distance:2.711,ads_E:-2.537
8 Cu54Ar ratio:1.14,dipole:0.008,distance:5.445,ads_E:-0.009 100 ratio:1.08,dipole:0.005,distance:4.631,ads_E:-0.014 hecc ratio:1.04,dipole:-0.018,distance:4.088,ads_E:-0.017