{ "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" [ 5.44038 0 0 ] "si-unit" "m" "si-value" [ 5.44038e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0177809 5.34742 0 ] "si-unit" "m" "si-value" [ 1.77809e-12 5.34742e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.258508 -0.216411 5.45927 ] "si-unit" "m" "si-value" [ 2.58508e-11 -2.16411e-11 5.459270000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0111666 -0.0485116 -0.0844937 ] [ 1.40892 1.32935 1.34318 ] [ 0.251238 2.67562 2.78628 ] [ 1.4893 4.10816 4.17197 ] [ 2.79244 -0.0558727 2.81547 ] [ 4.18247 1.3542 3.88471 ] [ 2.61313 2.71504 -0.144964 ] [ 4.08224 4.0407 1.29994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.11666e-12 -4.851160000000001e-12 -8.44937e-12 ] [ 1.40892e-10 1.32935e-10 1.34318e-10 ] [ 2.51238e-11 2.67562e-10 2.78628e-10 ] [ 1.4893e-10 4.10816e-10 4.17197e-10 ] [ 2.79244e-10 -5.58727e-12 2.81547e-10 ] [ 4.182470000000001e-10 1.3542e-10 3.88471e-10 ] [ 2.61313e-10 2.71504e-10 -1.44964e-11 ] [ 4.08224e-10 4.0407e-10 1.29994e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.469009 14.4523741 10.0013574 ] [ 0.8650263 -2.7142312 -0.8738546 ] [ -2.2182545 3.4779139 -2.0131824 ] [ 10.7420613 -14.4873843 -9.2877954 ] [ -0.9797598 2.6570423 -4.5227396 ] [ 3.1213457 -3.2138448 3.7418235 ] [ -0.9534247 3.4808527 2.2568096 ] [ 0.8920147 -3.6527226 0.6975814 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.837537808354479e-08 2.315525589807544e-08 1.602394100254508e-08 ] [ 1.385924914237127e-09 -4.34867777208593e-09 -1.400069410098536e-09 ] [ -3.554035498884394e-09 5.572232339735349e-09 -3.225473774686034e-09 ] [ 1.721067947406045e-08 -2.321134842200497e-08 -1.488068864865379e-08 ] [ -1.569748245559684e-09 4.257051053536661e-09 -7.246227649086344e-09 ] [ 5.000947105974611e-09 -5.149147001439652e-09 5.995062130860029e-09 ] [ -1.527554764033254e-09 5.576940816388556e-09 3.615807578717e-09 ] [ 1.429165097749926e-09 -5.852306751987791e-09 1.117648610184933e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.319319 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.178125730197723e-18 } }