{ "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" [ 5.50751 0 0 ] "si-unit" "m" "si-value" [ 5.50751e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0552432 5.46365 0 ] "si-unit" "m" "si-value" [ 5.52432e-12 5.46365e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.041151 -0.173599 5.4807 ] "si-unit" "m" "si-value" [ -4.115100000000001e-12 -1.73599e-11 5.4807e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0203681 -0.0104771 -0.043973 ] [ 1.36957 1.30557 1.36025 ] [ 0.0138031 2.57027 2.84477 ] [ 1.29725 4.08516 4.13225 ] [ 2.77149 -0.00701058 2.61036 ] [ 3.98017 1.30013 4.07827 ] [ 2.6961 2.74296 0.249943 ] [ 4.17055 4.00651 1.44609 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03681e-12 -1.04771e-12 -4.3973e-12 ] [ 1.36957e-10 1.30557e-10 1.36025e-10 ] [ 1.38031e-12 2.57027e-10 2.84477e-10 ] [ 1.29725e-10 4.08516e-10 4.13225e-10 ] [ 2.77149e-10 -7.01058e-13 2.61036e-10 ] [ 3.98017e-10 1.30013e-10 4.07827e-10 ] [ 2.6961e-10 2.74296e-10 2.49943e-11 ] [ 4.170550000000001e-10 4.00651e-10 1.44609e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.3719493 3.0102412 2.9483688 ] [ -1.7026432 -0.7034915 1.3166624 ] [ -0.6504569 1.2127608 -1.1296921 ] [ 5.5808536 -3.6128958 -2.5784568 ] [ -2.2564734 -1.4838475 2.5751918 ] [ 1.4542917 -0.3837998 2.6404574 ] [ -0.1078381 1.3814761 -5.5360233 ] [ 3.0542157 0.5795564 -0.2365082 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.606811576582926e-09 4.822938073608936e-09 4.723807560856151e-09 ] [ -2.727935128604098e-09 -1.127117634231523e-09 2.109525714766418e-09 ] [ -1.042146838018044e-09 1.943057000382705e-09 -1.809966271322456e-09 ] [ 8.941513162027515e-09 -5.788497184146513e-09 -4.131143202702781e-09 ] [ -3.615268926937087e-09 -2.377385773332528e-09 4.125912096035869e-09 ] [ 2.330032161563487e-09 -6.149150666277159e-10 4.230479114498354e-09 ] [ -1.727756826514925e-10 2.213368709613963e-09 -8.869687103464064e-09 ] [ 4.893392989420306e-09 9.285517145150131e-10 -3.789279086674906e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.086757 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.621518176509074e-18 } }