ASE database

Displaying rows 1-8 out of 8
↓ ID ✕ no_equ_10 ✕ no_equ_4 ✕ Energy ✕
1 ratio:1.17,dipole:-3.222,distance:3.904,ads_E:-0.582 ratio:1,dipole:-2.353,distance:1.877,ads_E:-2.141 -193.113
2 ratio:1.2,dipole:-0.359907,distance:3.18592,ads_E:-0.372501 ratio:1,dipole:0.00345513,distance:0.973808,ads_E:-2.95616 -193.566
3 ratio:1.200,dipole:0.935,distance:2.451,ads_E:-2.045 ratio:1.000,dipole:0.557,distance:0.353,ads_E:-5.662 -196.413
4 ratio:1.2,dipole:1.54212,distance:2.34852,ads_E:-2.29339 ratio:1,dipole:0.52283,distance:0.266163,ads_E:-6.42427 -198.094
5 ratio:1.2,dipole:1.380,distance:2.488,ads_E:-0.433 ratio:1,dipole:0.368,distance:0.386,ads_E:-4.725 -198.315
6 ratio:1.200,dipole:3.021,distance:2.955,ads_E:-0.945 ratio:1.000,dipole:0.486,distance:0.778,ads_E:-5.406 -197.510
7 ratio:1.250,dipole:6.761,distance:4.069,ads_E:-1.287 ratio:1.000,dipole:0.693,distance:1.239,ads_E:-4.335 -195.280
8 ratio:1.08,dipole:0.005,distance:4.631,ads_E:-0.014 ratio:0.96,dipole:-0.291,distance:3.002,ads_E:0.057 -190.598