{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.56756e-10 0.0 0.0 ] "source-value" [ 5.56756 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 6.033250000000001e-11 5.387920000000001e-10 0.0 ] "source-value" [ 0.603325 5.38792 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.02741e-11 -4.50618e-11 5.48706e-10 ] "source-value" [ -0.402741 -0.450618 5.48706 ] } "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" [ [ 2.811242016331579e-08 -5.056862845735804e-08 4.418269595351674e-08 ] [ 3.020559069891942e-09 -2.847378837643697e-09 6.025142996915549e-09 ] [ -2.372267620117383e-09 2.748797070383535e-09 2.079559404339285e-09 ] [ -9.34480072425531e-09 5.162154112117955e-09 -1.198172180664993e-08 ] [ -8.871771054594739e-09 1.884311944883308e-08 2.451492626446284e-08 ] [ -3.788102271925162e-08 5.064320849731498e-08 -5.479915195214879e-08 ] [ -1.040343588231333e-09 -2.037783898649689e-08 -8.753105522739865e-09 ] [ 2.837722663346032e-08 -3.603432847150927e-09 -1.268345337695829e-09 ] ] "source-value" [ [ 17.546392700000002 -31.562455600000007 27.576670000000007 ] [ 1.8852847000000004 -1.7771941000000004 3.760598500000001 ] [ -1.4806530000000002 1.7156642000000004 1.2979589000000002 ] [ -5.8325659000000005 3.2219632000000007 -7.478402600000002 ] [ -5.537324000000001 11.760950200000002 15.301013600000003 ] [ -23.643474900000005 31.609004800000008 -34.202940700000006 ] [ -0.6493314000000001 -12.718846800000003 -5.463258800000001 ] [ 17.711671900000002 -2.2490859000000003 -0.7916389000000003 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -3.36492e-11 6.38405e-12 1.89929e-11 ] [ 1.53887e-10 1.35333e-10 1.11771e-10 ] [ 3.18438e-11 2.15889e-10 3.01891e-10 ] [ 1.68585e-10 3.81794e-10 4.45016e-10 ] [ 2.72641e-10 -3.20403e-11 2.65546e-10 ] [ 4.33601e-10 7.481900000000001e-11 4.56114e-10 ] [ 3.14234e-10 2.88247e-10 7.698180000000001e-12 ] [ 4.12798e-10 3.93896e-10 1.35009e-10 ] ] "source-value" [ [ -0.336492 0.0638405 0.189929 ] [ 1.53887 1.35333 1.11771 ] [ 0.318438 2.15889 3.01891 ] [ 1.68585 3.81794 4.45016 ] [ 2.72641 -0.320403 2.65546 ] [ 4.33601 0.74819 4.56114 ] [ 3.14234 2.88247 0.0769818 ] [ 4.12798 3.93896 1.35009 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.978682659118768e-18 "source-value" -18.591475 } }