{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.48715e-10 0.0 0.0 ] "source-value" [ 5.48715 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 8.53536e-12 5.45185e-10 0.0 ] "source-value" [ 0.0853536 5.45185 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -9.25937e-12 3.73061e-12 5.50955e-10 ] "source-value" [ -0.0925937 0.0373061 5.50955 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.703684423054008e-09 -1.547267945175577e-09 1.654156837996925e-09 ] [ 1.300770668800566e-09 -1.101333325220003e-09 -8.292959115504807e-10 ] [ -2.934952049342342e-10 -2.2444491736632e-10 3.666889135047318e-09 ] [ -1.844913588645993e-09 -2.569593294911731e-09 2.075803421687144e-09 ] [ 2.032519338534935e-09 3.481432384659856e-09 2.375856495747975e-10 ] [ -2.150754846184788e-09 1.326265784932032e-09 -4.143632489897242e-10 ] [ 1.088138920094728e-09 -1.089424506615258e-09 -3.108552372300561e-09 ] [ 2.571418975171133e-09 1.724365979914664e-09 -3.282223511465418e-09 ] ] "source-value" [ [ -1.6875071 -0.9657287 1.0324435 ] [ 0.8118772 -0.6873982 -0.5176058 ] [ -0.1831853 -0.1400875 2.2886922 ] [ -1.1515045 -1.603814 1.2956146 ] [ 1.2685988 2.1729392 0.1482893 ] [ -1.3423956 0.82779 -0.2586252 ] [ 0.6791629 -0.6799653 -1.9402058 ] [ 1.6049535 1.0762646 -2.0486028 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.825109643632049e-18 "source-value" -36.357475 } }