{ "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" [ 5.48581 0 0 ] "si-unit" "m" "si-value" [ 5.48581e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00228581 5.44331 0 ] "si-unit" "m" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0206328 -0.0957916 5.42731 ] "si-unit" "m" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4061398 0.4256277 -0.2282981 ] [ -0.431215 0.9802303 -0.8630883 ] [ 0.120557 -0.0385604 0.630241 ] [ 0.1146215 -0.392445 -0.4794472 ] [ 0.5512611 0.3975743 2.4566718 ] [ -1.1178825 0.3502593 -0.6626642 ] [ -0.4742878 -0.8206248 -0.9009648 ] [ 0.8308059 -0.9020615 0.0475498 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.507076923363878e-10 6.819307501048762e-10 -3.657738783930605e-10 ] [ -6.908825915382721e-10 1.57050206965977e-09 -1.382819895946017e-09 ] [ 1.931536068737856e-10 -6.178057136869632e-11 1.009757395669613e-09 ] [ 1.836438875410272e-10 -6.28766203949856e-10 -7.681590947480218e-10 ] [ 8.832176463764908e-10 6.369842484909254e-10 3.936022122938654e-09 ] [ -1.791045206301456e-09 5.611772616777735e-10 -1.061705088681135e-09 ] [ -7.598928246906663e-10 -1.314785869008676e-09 -1.443504738723748e-09 ] [ 1.331097789402703e-09 -1.445261845823779e-09 7.618317788371584e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -17.549983240654235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.811817284360804e-18 } }