{ "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" [ 5.47373 0 0 ] "si-unit" "m" "si-value" [ 5.47373e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.128217 5.8305 0 ] "si-unit" "m" "si-value" [ -1.28217e-11 5.8305e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.28854 -0.0943746 5.99929 ] "si-unit" "m" "si-value" [ 2.8854e-11 -9.437460000000001e-12 5.99929e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.153552 -0.151682 0.285368 ] [ 1.56659 1.11428 1.80298 ] [ 0.0114317 2.78427 2.63644 ] [ 1.58247 4.14354 3.67768 ] [ 2.87662 -0.0580046 2.88139 ] [ 4.22527 1.43863 4.17233 ] [ 2.56962 2.98931 0.105287 ] [ 4.06718 4.1162 1.17836 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.53552e-11 -1.51682e-11 2.85368e-11 ] [ 1.56659e-10 1.11428e-10 1.80298e-10 ] [ 1.14317e-12 2.78427e-10 2.63644e-10 ] [ 1.58247e-10 4.14354e-10 3.67768e-10 ] [ 2.87662e-10 -5.800460000000001e-12 2.88139e-10 ] [ 4.22527e-10 1.43863e-10 4.17233e-10 ] [ 2.56962e-10 2.98931e-10 1.05287e-11 ] [ 4.067179999999999e-10 4.1162e-10 1.17836e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2761476 -3.478093 3.728196 ] [ 2.5405431 -3.4862485 3.5289692 ] [ 0.43408 0.8805228 -0.3664829 ] [ -0.0035589 1.6629694 -4.1059257 ] [ -3.3938477 0.5512759 -1.4690894 ] [ -0.63499 0.8853645 -1.3562896 ] [ 2.3705821 2.1693292 2.8584095 ] [ -0.036661 0.8148797 -2.8177871 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.044613866255179e-09 -5.572519335478961e-09 5.973228518172264e-09 ] [ 4.070398792489925e-09 -5.585585887017548e-09 5.654031994345672e-09 ] [ 6.954728332867199e-10 1.410753055864255e-09 -5.871703391405585e-10 ] [ -5.701986422742599e-12 2.664370715736999e-09 -6.578418217480094e-09 ] [ -5.437543484294641e-09 8.832413658673206e-10 -2.35374070993708e-09 ] [ -1.01736614082366e-09 1.418510314473093e-09 -2.173015506057206e-09 ] [ 3.798091249598651e-09 3.475648555693912e-09 4.579676911303623e-09 ] [ -5.873739757907399e-11 1.30558121486093e-09 -4.51459265120662e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 4.535307398437524 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.266363541783929e-19 } }