{ "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" [ 5.4238 0 0 ] "si-unit" "m" "si-value" [ 5.4238e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0012341 5.50722 0 ] "si-unit" "m" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00966142 -0.113973 5.43239 ] "si-unit" "m" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0339885 -0.0385369 0.0299316 ] [ 1.35039 1.32575 1.36375 ] [ -0.105411 2.62445 2.64243 ] [ 1.34087 3.97443 4.1654 ] [ 2.65221 0.0889868 2.75972 ] [ 4.05512 1.26127 4.10909 ] [ 2.71709 2.70534 0.0564386 ] [ 4.05687 4.02913 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.39885e-12 -3.85369e-12 2.99316e-12 ] [ 1.35039e-10 1.32575e-10 1.36375e-10 ] [ -1.05411e-11 2.62445e-10 2.64243e-10 ] [ 1.34087e-10 3.97443e-10 4.1654e-10 ] [ 2.652210000000001e-10 8.89868e-12 2.75972e-10 ] [ 4.05512e-10 1.26127e-10 4.10909e-10 ] [ 2.71709e-10 2.70534e-10 5.64386e-12 ] [ 4.05687e-10 4.02913e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0142409 -0.1005191 0.069631 ] [ -0.5607457 0.3065874 -0.3882334 ] [ 1.205178 0.2761742 1.5981567 ] [ 0.6320388 1.2772303 -2.1716163 ] [ 0.5351825 -5.0498885 -0.3417293 ] [ 0.3948135 0.4822814 0.2683717 ] [ -0.3946162 -0.0461352 -0.443421 ] [ -1.8260918 2.8542696 1.4088407 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.28164372271306e-11 -1.610493532907094e-10 1.11561161202054e-10 ] [ -8.984136581559737e-10 4.912071685588116e-10 -6.220184820183755e-10 ] [ 1.930908031410852e-09 4.424798501536427e-10 2.560529322210547e-09 ] [ 1.012637797141399e-09 2.04634854289681e-09 -3.479312893873534e-09 ] [ 8.574568964257049e-10 -8.090813359005309e-09 -5.475106996131762e-10 ] [ 6.325609644877589e-10 7.726999900928076e-10 4.299788669668577e-10 ] [ -6.322448550378707e-10 -7.391673944491679e-11 -7.104387652249139e-10 ] [ -2.925721613499001e-09 4.573044060256525e-09 2.257211650568204e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.475928 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.844087954506635e-18 } }