{ "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" [ 5.44445 0 0 ] "si-unit" "m" "si-value" [ 5.44445e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.167308 5.39053 0 ] "si-unit" "m" "si-value" [ 1.67308e-11 5.39053e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00577721 0.0671422 5.23553 ] "si-unit" "m" "si-value" [ 5.77721e-13 6.71422e-12 5.23553e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0663122 0.114884 -0.548352 ] [ 1.65266 1.49476 1.67932 ] [ 0.0154179 2.74054 2.60324 ] [ 1.52833 4.11061 4.06642 ] [ 2.73369 0.0515698 2.61947 ] [ 3.80738 1.47511 4.06717 ] [ 2.81179 3.14543 -0.204063 ] [ 4.02065 4.01269 1.26672 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.63122e-12 1.14884e-11 -5.48352e-11 ] [ 1.65266e-10 1.49476e-10 1.67932e-10 ] [ 1.54179e-12 2.74054e-10 2.60324e-10 ] [ 1.52833e-10 4.11061e-10 4.06642e-10 ] [ 2.733690000000001e-10 5.15698e-12 2.61947e-10 ] [ 3.807380000000001e-10 1.47511e-10 4.06717e-10 ] [ 2.81179e-10 3.14543e-10 -2.04063e-11 ] [ 4.02065e-10 4.01269e-10 1.26672e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4328892 -0.2755273 12.3451955 ] [ -5.2740116 2.7829849 -10.4475943 ] [ -0.4589317 0.356755 2.5192956 ] [ -6.5685765 4.1028759 -12.1833951 ] [ -0.7148508 -1.6739467 1.9475758 ] [ 3.2120127 0.9017297 -4.140462 ] [ 3.3000372 -11.1238522 10.3578965 ] [ 5.0714315 4.9289807 -0.3985119 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.295741576436815e-09 -4.414433984521478e-10 1.977918360930537e-08 ] [ -8.449898083348e-09 4.458833342819426e-09 -1.673889133106334e-08 ] [ -7.352896402839994e-10 5.71584520353504e-10 4.036356511204309e-09 ] [ -1.052401970023629e-08 6.573531845023759e-09 -1.951995079118928e-08 ] [ -1.145317239120177e-09 -2.681958267205311e-09 3.120360413995857e-09 ] [ 5.146211653652685e-09 1.444730243620998e-09 -6.63375141571081e-09 ] [ 5.287242449610294e-09 -1.782237592807465e-08 1.659517961296615e-08 ] [ 8.125328983288676e-09 7.897097641914419e-09 -6.384864492905875e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.60851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.462064953232301e-18 } }