{ "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" [ 5.4726 0 0 ] "si-unit" "m" "si-value" [ 5.4726e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038105 5.56078 0 ] "si-unit" "m" "si-value" [ 3.8105e-12 5.560780000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0300683 -0.0732695 5.55519 ] "si-unit" "m" "si-value" [ -3.00683e-12 -7.32695e-12 5.55519e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0119551 0.065874 -0.0174062 ] [ 1.35048 1.36142 1.35358 ] [ 0.0629681 2.82177 2.8468 ] [ 1.33242 4.00392 4.21267 ] [ 2.75302 -0.0155517 2.72 ] [ 4.0777 1.32793 4.00537 ] [ 2.56601 2.8685 0.00815077 ] [ 4.04738 3.99965 1.27482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.19551e-12 6.587400000000001e-12 -1.74062e-12 ] [ 1.35048e-10 1.36142e-10 1.35358e-10 ] [ 6.296810000000001e-12 2.82177e-10 2.8468e-10 ] [ 1.33242e-10 4.00392e-10 4.21267e-10 ] [ 2.75302e-10 -1.55517e-12 2.72e-10 ] [ 4.0777e-10 1.32793e-10 4.00537e-10 ] [ 2.56601e-10 2.8685e-10 8.15077e-13 ] [ 4.047380000000001e-10 3.99965e-10 1.27482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0720955 -1.0855065 -0.5427017 ] [ 0.0310557 0.5579918 0.7580274 ] [ -1.5441912 -1.7231268 -2.0665201 ] [ 0.0323491 3.4571496 -0.7795443 ] [ -0.8689741 -1.2531029 -0.3666059 ] [ 0.3290413 0.7104412 1.7456748 ] [ 1.7527941 -2.7723658 0.0153621 ] [ 1.3400207 2.1085194 1.2363077 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.717686345364887e-09 -1.739173136026435e-09 -8.695039758084153e-10 ] [ 4.975671648257856e-11 8.940014165581096e-10 1.21449377820581e-09 ] [ -2.474067038685097e-09 -2.760753473633917e-09 -3.310930190633278e-09 ] [ 5.182897172392128e-11 5.538964263728072e-09 -1.248967652337901e-09 ] [ -1.392249987100721e-09 -2.00769216983668e-09 -5.873674020273428e-10 ] [ 5.27182278137639e-10 1.138252281093097e-09 2.796879352079716e-09 ] [ 2.808285728096177e-09 -4.441819669065489e-09 2.461279746639168e-11 ] [ 2.146949836928051e-09 3.378220487183244e-09 1.98078329305502e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.670025 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.714968011835153e-18 } }