{ "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" [ 5.40534 0 0 ] "si-unit" "m" "si-value" [ 5.40534e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0241155 5.39517 0 ] "si-unit" "m" "si-value" [ 2.41155e-12 5.395170000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0520891 0.00914509 5.32386 ] "si-unit" "m" "si-value" [ -5.20891e-12 9.14509e-13 5.32386e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0541257 0.0304247 -0.104173 ] [ 1.34 1.36746 1.32858 ] [ -0.0983731 2.60813 2.63031 ] [ 1.3236 4.08084 4.09012 ] [ 2.69861 0.0115312 2.71277 ] [ 4.03614 1.39677 4.05029 ] [ 2.56533 2.8449 0.01686 ] [ 4.17154 4.11014 1.29552 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.41257e-12 3.04247e-12 -1.04173e-11 ] [ 1.34e-10 1.36746e-10 1.32858e-10 ] [ -9.837310000000001e-12 2.60813e-10 2.63031e-10 ] [ 1.3236e-10 4.08084e-10 4.09012e-10 ] [ 2.69861e-10 1.15312e-12 2.71277e-10 ] [ 4.03614e-10 1.39677e-10 4.05029e-10 ] [ 2.56533e-10 2.8449e-10 1.686e-12 ] [ 4.17154e-10 4.11014e-10 1.29552e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.2539602 -0.4281958 2.4548136 ] [ 0.119204 -0.7355872 -0.4421688 ] [ 1.5168609 2.0717935 0.4793559 ] [ -3.6828567 3.1492877 -6.0297 ] [ -0.308913 -0.2524581 -0.4808348 ] [ -3.3662315 1.8124073 -0.6267233 ] [ 5.9124528 -4.9759788 3.9550393 ] [ -2.4444765 -0.6412686 0.6902182 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.611242336653692e-09 -6.860452998847526e-10 3.933044958341883e-09 ] [ 1.909858619058432e-10 -1.178540614399734e-09 -7.08432513807191e-10 ] [ 2.430279070985647e-09 3.319379108825405e-09 7.680128160225428e-10 ] [ -5.90058690249664e-09 5.045715125113004e-09 -9.66064437043776e-09 ] [ -4.949331864611903e-10 -4.044824655515885e-10 -7.703822750270439e-10 ] [ -5.393297409500515e-09 2.903796603427252e-09 -1.004121418970625e-09 ] [ 9.472793647743499e-09 -7.97239689895644e-09 6.336671500805198e-09 ] [ -3.916483098395011e-09 -1.027425558573147e-09 1.105851463290658e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.501536 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.687973098168956e-18 } }