{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.7953067 1.6138244 -1.3075231 ] [ -1.2627978 2.8263953 1.8766521 ] [ -8.4354271 -2.633437 -2.3659357 ] [ 0.769407 -4.6896933 1.3187699 ] [ 0.258475 -0.6265848 0.5631133 ] [ 6.7530948 3.4692913 0.3386507 ] [ -0.8780586 0.040204 -0.4237273 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.478575042705599e-09 2.585631723756588e-09 -2.094882941975941e-09 ] [ -2.023225111957674e-09 4.528384470799003e-09 3.006728119995224e-09 ] [ -1.351504408608275e-08 -4.219231193749689e-09 -3.790646864856082e-09 ] [ 1.232725907279865e-09 -7.513716963982402e-09 2.112902301994754e-09 ] [ 4.1412260206128e-10 -1.003899517508644e-09 9.022069641215367e-10 ] [ 1.081965060660605e-08 5.558417411604839e-09 5.425782341575546e-10 ] [ -1.406804960612379e-09 6.44139088626432e-11 -6.788859736547079e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.393371 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.985636926910072e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3046641 1.9973427 3.2645393 ] [ 3.1714614 5.2778415 2.5376148 ] [ 2.2166364 3.4637044 1.2344211 ] [ 4.4407045 2.2740702 1.8252547 ] [ 5.5351615 3.1911148 3.9867325 ] [ 5.4471346 4.6574779 1.9566155 ] [ 3.2575405 3.8439395 4.5227951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3046641e-10 1.9973427e-10 3.2645393e-10 ] [ 3.1714614e-10 5.2778415e-10 2.5376148e-10 ] [ 2.2166364e-10 3.4637044e-10 1.2344211e-10 ] [ 4.4407045e-10 2.2740702e-10 1.8252547e-10 ] [ 5.5351615e-10 3.1911148e-10 3.9867325e-10 ] [ 5.4471346e-10 4.6574779e-10 1.9566155e-10 ] [ 3.2575405e-10 3.8439395e-10 4.5227951e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 5e-06 -4.4e-06 ] [ 2.5e-06 1.4e-06 3.4e-06 ] [ 2.4e-06 -6.8e-06 6.6e-06 ] [ -2e-07 3.4e-06 2.4e-06 ] [ -3.5e-06 3.4e-06 -7.6e-06 ] [ -1.2e-06 -4.9e-06 4.3e-06 ] [ -6e-07 -1.4e-06 -4.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-15 8.010883104e-15 -7.04957713152e-15 ] [ 4.005441552e-15 2.24304726912e-15 5.44740051072e-15 ] [ 3.84522388992e-15 -1.089480102144e-14 1.057436569728e-14 ] [ -3.2043532416e-16 5.44740051072e-15 3.84522388992e-15 ] [ -5.6076181728e-15 5.44740051072e-15 -1.217654231808e-14 ] [ -1.92261194496e-15 -7.850665441919999e-15 6.889359469440001e-15 ] [ -9.6130597248e-16 -2.24304726912e-15 -7.53023011776e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.735789 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.841586648724181e-18 } }