{ "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" [ [ -1.627437979362492e-09 -4.639632725987884e-10 6.436219060132377e-10 ] [ 1.308131548849507e-09 -1.083728928945976e-09 -8.939421360231398e-10 ] [ -1.472283355621882e-10 -1.395466997537626e-10 3.06308436219654e-09 ] [ -2.355310983851145e-09 -2.505062747591094e-09 2.739815909117979e-09 ] [ 2.093858830679925e-09 3.364896305751684e-09 -8.087617751076596e-10 ] [ -1.251910049702001e-09 6.756168924776274e-10 -4.446951761217235e-10 ] [ 4.749899327561203e-10 -5.41437484403545e-10 -2.198888397532835e-09 ] [ 1.504907036192273e-09 6.932256146285299e-10 -2.100234692542399e-09 ] ] "source-value" [ [ -1.0157669 -0.2895831 0.4017172 ] [ 0.8164715 -0.6764104 -0.5579548 ] [ -0.0918927 -0.0870982 1.9118269 ] [ -1.4700695 -1.5635372 1.7100586 ] [ 1.3068839 2.1002031 -0.5047894 ] [ -0.7813808 0.4216869 -0.2775569 ] [ 0.2964654 -0.3379387 -1.3724382 ] [ 0.9392891 0.4326774 -1.3108634 ] ] } "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" -5.825314562021848e-18 "source-value" -36.358754 } }