ASE database

Displaying rows 1-18 out of 18
↓ ID ✕ Formula ✕ Maximum stress ✕ no_equ_5 ✕ no_equ_13 ✕ no_equ_15 ✕ Magnetic moment ✕ no_equ_10 ✕
1 Cu54Li 0.009 ratio:1.03,dipole:-2.924,distance:2.235,ads_E:-2.040 ratio:1.35,dipole:-2.533,distance:6.051,ads_E:-0.126 ratio:1.7,dipole:-2.867,distance:10.224,ads_E:-0.066 0.000 ratio:1.17,dipole:-3.222,distance:3.904,ads_E:-0.582
2 BeCu54 0.008 ratio:1.03,dipole:-0.173906,distance:1.30562,ads_E:-2.87935 ratio:1.35,dipole:-0.0991408,distance:4.845,ads_E:-0.0276465 ratio:1.45,dipole:-0.0224294,distance:5.95106,ads_E:-0.00714774 -0.000 ratio:1.2,dipole:-0.359907,distance:3.18592,ads_E:-0.372501
3 Cu54B 0.008 ratio:1.030,dipole:0.635,distance:0.668,ads_E:-5.579 ratio:1.400,dipole:-0.694,distance:4.626,ads_E:-0.236 ratio:1.900,dipole:-0.558,distance:9.794,ads_E:-0.180 0.000 ratio:1.200,dipole:0.935,distance:2.451,ads_E:-2.045
4 Cu54C 0.008 ratio:1.03,dipole:0.653681,distance:0.578516,ads_E:-6.33223 ratio:1.35,dipole:2.50975,distance:3.91028,ads_E:-0.271632 ratio:1.45,dipole:2.19263,distance:4.95146,ads_E:-0.182345 -0.000 ratio:1.2,dipole:1.54212,distance:2.34852,ads_E:-2.29339
5 Cu54N 0.007 ratio:1.03,dipole:0.566,distance:0.701,ads_E:-4.655 ratio:1.33,dipole:0.416,distance:3.855,ads_E:-0.042 ratio:1.4,dipole:-0.095,distance:4.680,ads_E:-0.016 -0.000 ratio:1.2,dipole:1.380,distance:2.488,ads_E:-0.433
6 Cu54O 0.009 ratio:1.030,dipole:0.754,distance:1.104,ads_E:-5.283 ratio:1.350,dipole:3.982,distance:4.588,ads_E:-0.321 ratio:1.900,dipole:6.642,distance:10.576,ads_E:-0.174 0.000 ratio:1.200,dipole:3.021,distance:2.955,ads_E:-0.945
7 Cu54F 0.009 ratio:1.030,dipole:1.159,distance:1.579,ads_E:-4.212 ratio:1.550,dipole:9.933,distance:7.465,ads_E:-0.801 ratio:1.900,dipole:13.468,distance:11.427,ads_E:-0.666 -0.000 ratio:1.250,dipole:6.761,distance:4.069,ads_E:-1.287
8 Cu54Ar 0.009 ratio:0.98,dipole:-0.177,distance:3.274,ads_E:0.014 ratio:1.14,dipole:0.008,distance:5.445,ads_E:-0.009 ratio:1.18,dipole:0.006,distance:5.987,ads_E:-0.007 -0.000 ratio:1.08,dipole:0.005,distance:4.631,ads_E:-0.014