ASE database

Displaying rows 1-25 out of 594
↓ ID ✕ Formula ✕ slab_E ✕ no_equ_31 ✕ Age ✕ no_equ_20 ✕ no_equ_15 ✕ no_equ_24 ✕ no_equ_22 ✕ no_equ_11 ✕ no_equ_25 ✕ no_equ_23 ✕
1 Cu54Li -190.592 - 15M - ratio:1.7,dipole:-2.867,distance:10.224,ads_E:-0.066 - - ratio:1.25,dipole:-2.667,distance:4.858,ads_E:-0.244 - -
2 BeCu54 -190.592 - 15M - ratio:1.45,dipole:-0.0224294,distance:5.95106,ads_E:-0.00714774 - - ratio:1.25,dipole:-0.291055,distance:3.73895,ads_E:-0.152313 - -
3 Cu54B -190.592 - 15M - ratio:1.900,dipole:-0.558,distance:9.794,ads_E:-0.180 - - ratio:1.250,dipole:-0.107,distance:2.976,ads_E:-0.989 - -
4 Cu54C -190.592 - 15M ratio:2.1,dipole:5.51535,distance:11.7191,ads_E:-0.0591715 ratio:1.45,dipole:2.19263,distance:4.95146,ads_E:-0.182345 - - ratio:1.25,dipole:1.94527,distance:2.86911,ads_E:-0.945693 - -
5 Cu54N -190.592 - 15M - ratio:1.4,dipole:-0.095,distance:4.680,ads_E:-0.016 - - ratio:1.25,dipole:0.908,distance:3.014,ads_E:-0.162 - -
6 Cu54O -190.592 - 15M - ratio:1.900,dipole:6.642,distance:10.576,ads_E:-0.174 - - ratio:1.250,dipole:3.446,distance:3.499,ads_E:-0.537 - -
7 Cu54F -190.592 - 15M - ratio:1.900,dipole:13.468,distance:11.427,ads_E:-0.666 - - ratio:1.300,dipole:7.369,distance:4.635,ads_E:-1.125 - -
8 Cu54Ar -190.592 ratio:1.5,dipole:0.000,distance:10.329,ads_E:-0.005 15M ratio:1.28,dipole:0.001,distance:7.344,ads_E:-0.005 ratio:1.18,dipole:0.006,distance:5.987,ads_E:-0.007 ratio:1.36,dipole:0.001,distance:8.429,ads_E:-0.005 ratio:1.32,dipole:0.002,distance:7.887,ads_E:-0.005 ratio:1.1,dipole:0.008,distance:4.902,ads_E:-0.012 ratio:1.38,dipole:0.000,distance:8.701,ads_E:-0.005 ratio:1.34,dipole:0.001,distance:8.158,ads_E:-0.005