{ "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" [ 5.48715 0 0 ] "si-unit" "m" "si-value" [ 5.48715e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0853536 5.45185 0 ] "si-unit" "m" "si-value" [ 8.53536e-12 5.45185e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0925937 0.0373061 5.50955 ] "si-unit" "m" "si-value" [ -9.25937e-12 3.73061e-12 5.50955e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.108625 -0.0346204 -0.093953 ] [ 1.31877 1.39109 1.34024 ] [ -0.0198257 2.75858 2.57664 ] [ 1.43337 4.133 3.94558 ] [ 2.6449 -0.0446732 2.70542 ] [ 4.12571 1.36749 4.0773 ] [ 2.7517 2.72879 0.0316261 ] [ 4.07324 4.11206 1.36119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08625e-11 -3.46204e-12 -9.3953e-12 ] [ 1.31877e-10 1.39109e-10 1.34024e-10 ] [ -1.98257e-12 2.75858e-10 2.57664e-10 ] [ 1.43337e-10 4.133e-10 3.94558e-10 ] [ 2.6449e-10 -4.467320000000001e-12 2.70542e-10 ] [ 4.12571e-10 1.36749e-10 4.0773e-10 ] [ 2.7517e-10 2.72879e-10 3.16261e-12 ] [ 4.07324e-10 4.11206e-10 1.36119e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0775591 -0.0672241 0.4953663 ] [ 0.9613989 -0.7456957 -0.8076744 ] [ -0.1275291 -0.0320282 2.1640783 ] [ -1.6194219 -1.7848685 1.7517435 ] [ 1.4759484 2.3322602 -0.5325247 ] [ -0.8655394 0.343432 -0.2228824 ] [ 0.3869975 -0.1715794 -1.3386117 ] [ 0.8657048 0.1257038 -1.5094949 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.726439997550289e-09 -1.077048813743213e-10 7.93664304592199e-10 ] [ 1.540330840842837e-09 -1.194736216771091e-09 -1.294037040898668e-09 ] [ -2.043241424916653e-10 -5.131483324630656e-11 3.467235657840609e-09 ] [ -2.594599907391516e-09 -2.859674581902364e-09 2.806602481338364e-09 ] [ 2.364730019987167e-09 3.736692766062332e-09 -8.531986243385336e-10 ] [ -1.38674699106126e-09 5.502387212345856e-10 -3.570969704677939e-10 ] [ 6.20038346808048e-10 -2.749005032908915e-10 -2.144692370069343e-09 ] [ 1.38701199107434e-09 2.01399689505719e-10 -2.418477437996834e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.285916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.813644627951265e-18 } }