{ "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" [ [ 54.7801072 -60.3615482 45.519649 ] [ -6.2432121 -0.0783863 0.3825325 ] [ 38.1488786 -56.0509714 43.9202928 ] [ -1.5688835 1.9186944 10.1842791 ] [ 9.8061418 3.450559 -3.2183855 ] [ -41.6935481 51.7913897 -58.0279794 ] [ -6.8428783 8.4631396 7.7024197 ] [ -46.3866057 50.8671232 -46.4628082 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.776740776385516e-08 -9.670986211810475e-08 7.293051801568146e-08 ] [ -1.000272854772607e-08 -1.255886982857142e-10 6.128846332456049e-10 ] [ 6.112124190622263e-08 -8.980355669008227e-08 7.036806688259843e-08 ] [ -2.513628485168139e-09 3.074087335466649e-09 1.631701400815455e-08 ] [ 1.57111712616507e-08 5.528405004038406e-09 -5.156422047304407e-09 ] [ -6.680042855437509e-08 8.297895441972827e-08 -9.297107271291333e-08 ] [ -1.096349972156564e-08 1.355944451740011e-08 1.234063686860129e-08 ] [ -7.431953578311121e-08 8.14981162298393e-08 -7.444162564806359e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -15.403861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.467970616758387e-18 } }