{ "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" [ 5.47373 0 0 ] "si-unit" "m" "si-value" [ 5.47373e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.128217 5.8305 0 ] "si-unit" "m" "si-value" [ -1.28217e-11 5.8305e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.28854 -0.0943746 5.99929 ] "si-unit" "m" "si-value" [ 2.8854e-11 -9.437460000000001e-12 5.99929e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.153552 -0.151682 0.285368 ] [ 1.56659 1.11428 1.80298 ] [ 0.0114317 2.78427 2.63644 ] [ 1.58247 4.14354 3.67768 ] [ 2.87662 -0.0580046 2.88139 ] [ 4.22527 1.43863 4.17233 ] [ 2.56962 2.98931 0.105287 ] [ 4.06718 4.1162 1.17836 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.53552e-11 -1.51682e-11 2.85368e-11 ] [ 1.56659e-10 1.11428e-10 1.80298e-10 ] [ 1.14317e-12 2.78427e-10 2.63644e-10 ] [ 1.58247e-10 4.14354e-10 3.67768e-10 ] [ 2.87662e-10 -5.800460000000001e-12 2.88139e-10 ] [ 4.22527e-10 1.43863e-10 4.17233e-10 ] [ 2.56962e-10 2.98931e-10 1.05287e-11 ] [ 4.067179999999999e-10 4.1162e-10 1.17836e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8903502 2.91443 -3.2473655 ] [ -3.5001147 2.8522879 -4.2975024 ] [ 0.1004439 -0.4180247 0.264854 ] [ -0.6770834 -1.1920965 4.2567498 ] [ 3.7710593 -1.4381819 0.1413432 ] [ 0.07243 -0.585573 2.6002181 ] [ -1.4634774 -2.2550553 -3.2008539 ] [ -0.1936078 0.1222134 3.4825567 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.028674895564604e-09 4.669431608958143e-09 -5.202853083292502e-09 ] [ -5.607801942458406e-09 4.569868989170728e-09 -6.88535787311189e-09 ] [ 1.609288682819731e-10 -6.697494012569338e-10 4.243428867253632e-10 ] [ -1.084807193811775e-09 -1.909949142037507e-09 6.820065010155075e-09 ] [ 6.041903046110414e-09 -2.304221416637724e-09 2.264567705490585e-10 ] [ 1.16045652644544e-10 -9.381913703717184e-10 4.166008648800997e-09 ] [ -2.344749275349169e-09 -3.61299688027113e-09 -5.128333285176501e-09 ] [ -3.101938907645223e-10 1.958074522284787e-10 5.579670925350399e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.305361 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.695236425830411e-18 } }