{ "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" [ 5.42981 0 0 ] "si-unit" "m" "si-value" [ 5.42981e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0370196 5.47054 0 ] "si-unit" "m" "si-value" [ 3.70196e-12 5.47054e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0339139 -0.0143321 5.52419 ] "si-unit" "m" "si-value" [ -3.39139e-12 -1.43321e-12 5.52419e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0865271 0.0202603 -0.0485063 ] [ 1.27669 1.31148 1.22292 ] [ -0.0137625 2.6467 2.79128 ] [ 1.29807 4.01993 4.311 ] [ 2.70854 -0.0697941 2.82717 ] [ 4.06866 1.27154 4.01384 ] [ 2.71531 2.7055 0.0603487 ] [ 4.06455 4.01651 1.33765 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.65271e-12 2.02603e-12 -4.850630000000001e-12 ] [ 1.27669e-10 1.31148e-10 1.22292e-10 ] [ -1.37625e-12 2.6467e-10 2.79128e-10 ] [ 1.29807e-10 4.019929999999999e-10 4.311e-10 ] [ 2.70854e-10 -6.97941e-12 2.82717e-10 ] [ 4.06866e-10 1.27154e-10 4.01384e-10 ] [ 2.71531e-10 2.7055e-10 6.03487e-12 ] [ 4.06455e-10 4.016510000000001e-10 1.33765e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1610426 0.7665073 -4.7213247 ] [ 2.6621654 8.4121292 -0.2051752 ] [ -3.7602071 -0.7293801 0.2190977 ] [ 0.7921121 -5.930028 1.5402668 ] [ 6.9324569 -0.5551387 -0.3181455 ] [ 4.2608631 -1.1900691 -5.2408275 ] [ -4.7603719 4.357495 4.5653861 ] [ -3.9659758 -5.1315156 4.1607222 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.462371930272846e-09 1.228080075732532e-09 -7.564396053545574e-09 ] [ 4.265259164582681e-09 1.347771673538901e-08 -3.287269086079642e-10 ] [ -6.024515904986168e-09 -1.168595743896766e-09 3.510332126110522e-10 ] [ 1.269103487672792e-09 -9.500952222289382e-09 2.467779456754429e-09 ] [ 1.110702036988364e-08 -8.89430246441305e-10 -5.097252821127264e-10 ] [ 6.826655243249413e-09 -1.906700889156498e-09 -8.396731294145711e-09 ] [ -7.626956564493276e-09 6.981476614252896e-09 7.31455487434529e-09 ] [ -6.354193705418576e-09 -8.221594323590485e-09 6.666211834483542e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.200831 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.595659266573189e-18 } }