{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.217403 3.1972605 2.6508485 ] [ -8.8210984 1.9693937 17.9202069 ] [ 8.5330345 -17.2257752 -23.1215583 ] [ -0.4265896 15.824096 1.0006766 ] [ -4.5027493 -3.764975 1.5498263 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.3592011767615e-09 5.122576065911157e-09 4.247127526973949e-09 ] [ -1.413295774269478e-08 3.155316569286805e-09 2.871133677162557e-08 ] [ 1.367142849301587e-08 -2.759873452797668e-08 -3.704482044992876e-08 ] [ -6.834718894274063e-10 2.535299686537287e-08 1.603260666710564e-09 ] [ -7.214199717219855e-09 -6.03215497259415e-09 2.483095484618674e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.4530648 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.930243104247883e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4330668 0.9981608 1.158673 ] [ 0.3119778 0.5123903 2.8155689 ] [ 1.6364232 -0.051486 0.4907638 ] [ 1.2021393 2.547544 1.221018 ] [ 2.782103 1.0158752 2.4926279 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.330668e-11 9.981608e-11 1.158673e-10 ] [ 3.119778e-11 5.123903e-11 2.8155689e-10 ] [ 1.6364232e-10 -5.1486e-12 4.907638e-11 ] [ 1.2021393e-10 2.547544e-10 1.221018e-10 ] [ 2.782103e-10 1.0158752e-10 2.4926279e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.36e-05 4.67e-05 7e-07 ] [ 3.65e-05 2.4e-06 4.47e-05 ] [ 7.24e-05 -1.18e-05 -6.1e-06 ] [ -4.9e-06 2e-07 -1.46e-05 ] [ -7.04e-05 -3.76e-05 -2.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.383313490239999e-14 7.482164880779999e-14 1.1215236438e-15 ] [ 5.847944714099999e-14 3.845223921599999e-15 7.16172955398e-14 ] [ 1.159975883016e-13 -1.89056842812e-14 -9.773277467399999e-15 ] [ -7.850665506599998e-15 3.204353268e-16 -2.33917788564e-14 ] [ -1.127932350336e-13 -6.024184143839999e-14 -3.95737628598e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.664158 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.868804140288417e-18 } }