ASE database

ID distance no_equ_28 Volume Magnetic moment no_equ_4 no_equ_7 no_equ_23
1 1.865 - 1730.483 0.000 ratio:1,dipole:-2.353,distance:1.877,ads_E:-2.141 ratio:1.1,dipole:-4.039,distance:3.069,ads_E:-1.290 -
2 1.012 - 1730.483 -0.000 ratio:1,dipole:0.00345513,distance:0.973808,ads_E:-2.95616 ratio:1.1,dipole:-0.434967,distance:2.07986,ads_E:-1.97799 -
3 0.409 - 1730.483 0.000 ratio:1.000,dipole:0.557,distance:0.353,ads_E:-5.662 ratio:1.100,dipole:0.778,distance:1.402,ads_E:-4.794 -
4 0.260 - 1730.483 -0.000 ratio:1,dipole:0.52283,distance:0.266163,ads_E:-6.42427 ratio:1.1,dipole:1.00519,distance:1.30734,ads_E:-5.4061 -
5 0.399 - 1730.483 -0.000 ratio:1,dipole:0.368,distance:0.386,ads_E:-4.725 ratio:1.1,dipole:1.088,distance:1.437,ads_E:-3.705 -
6 0.772 - 1730.483 0.000 ratio:1.000,dipole:0.486,distance:0.778,ads_E:-5.406 ratio:1.100,dipole:1.502,distance:1.866,ads_E:-3.941 -
7 1.238 - 1730.483 -0.000 ratio:1.000,dipole:0.693,distance:1.239,ads_E:-4.335 ratio:1.100,dipole:3.086,distance:2.371,ads_E:-3.138 -
8 3.861 ratio:1.44,dipole:0.000,distance:9.515,ads_E:-0.005 1730.483 -0.000 ratio:0.96,dipole:-0.291,distance:3.002,ads_E:0.057 ratio:1.02,dipole:-0.049,distance:3.817,ads_E:-0.015 ratio:1.34,dipole:0.001,distance:8.158,ads_E:-0.005