{ "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" [ [ 4.9691828 -3.1702328 4.0510052 ] [ -0.7706405 -0.3097227 0.7027669 ] [ 2.8126311 -4.6689986 2.6788163 ] [ 0.5568326 0.6834715 1.7038268 ] [ 0.7926369 0.4751128 -1.134108 ] [ -2.6307749 2.7359564 -6.1076111 ] [ -1.4923382 0.1601148 0.8452331 ] [ -4.2375298 4.0942986 -2.7399292 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.961508506641482e-09 -5.079272874653322e-09 6.490425822179227e-09 ] [ -1.234702192141622e-09 -4.962304688710522e-10 1.125956697052091e-09 ] [ 4.506331791354986e-09 -7.48056039946793e-09 4.291936847277959e-09 ] [ 8.921441734192781e-10 1.095042058283107e-09 2.729831464852478e-09 ] [ 1.269944309963387e-09 7.612146204028263e-10 -1.817041323062246e-09 ] [ -4.214966039367458e-09 4.383485379608134e-09 -9.785471713358571e-09 ] [ -2.390989374366755e-09 2.565321892040679e-10 1.354212711946309e-09 ] [ -6.789271175503299e-09 6.559789495494171e-09 -4.389850506887248e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.450837 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.519632560839161e-18 } }