{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.33088 0 0 ] "si-unit" "m" "si-value" [ 5.33088e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0480326 5.46857 0 ] "si-unit" "m" "si-value" [ 4.80326e-12 5.46857e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109209 0.182969 5.33745 ] "si-unit" "m" "si-value" [ -1.09209e-11 1.82969e-11 5.33745e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0970486 -0.0788825 -0.10937 ] [ 1.39157 1.38931 1.26283 ] [ -0.0444574 2.82173 2.6602 ] [ 1.24826 4.17435 3.90061 ] [ 2.67605 0.0682538 2.80056 ] [ 3.9766 1.50429 4.31462 ] [ 2.81042 2.80539 0.0255717 ] [ 4.1826 4.03217 1.44291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.70486e-12 -7.88825e-12 -1.0937e-11 ] [ 1.39157e-10 1.38931e-10 1.26283e-10 ] [ -4.44574e-12 2.82173e-10 2.6602e-10 ] [ 1.24826e-10 4.17435e-10 3.90061e-10 ] [ 2.67605e-10 6.825380000000001e-12 2.80056e-10 ] [ 3.9766e-10 1.50429e-10 4.31462e-10 ] [ 2.81042e-10 2.80539e-10 2.55717e-12 ] [ 4.1826e-10 4.03217e-10 1.44291e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.9451631 -2.614428 2.9812878 ] [ -0.5112661 -0.3025869 0.5224651 ] [ 2.3453492 -4.2345191 2.1471361 ] [ 0.63305 0.6251418 1.0694973 ] [ 0.5698258 0.5207112 -0.8864859 ] [ -2.2200508 2.3121115 -4.4259612 ] [ -1.395492 0.2346703 0.7438472 ] [ -3.3665791 3.4588992 -2.1517865 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.320848136139004e-09 -4.188775452875352e-09 4.776549652389265e-09 ] [ -8.191385991763072e-10 -4.847976609344945e-10 8.370813753004732e-10 ] [ 3.757663686810593e-09 -6.784447558246709e-09 3.440091289437887e-09 ] [ 1.0142579181537e-09 1.001587584896701e-09 1.713523584186088e-09 ] [ 9.129615822103572e-10 8.342713177021008e-10 -1.42030699535046e-09 ] [ -3.556913518053007e-09 3.704411020502691e-09 -7.091171617630599e-09 ] [ -2.235824675333928e-09 3.759832713537702e-10 1.191774603106325e-09 ] [ -5.39385437053275e-09 5.541767477601292e-09 -3.447542051656641e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -24.660678074190162 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.95107621890636e-18 } }