{ "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" [ [ -2.4709034 -0.971434 -0.0802136 ] [ 1.4679559 0.5176414 2.5680307 ] [ 0.2780603 0.4654077 -0.8080342 ] [ 0.9565196 -0.0800659 -1.8646677 ] [ -1.2636207 -0.63488 -1.2264364 ] [ -0.1145326 0.6821448 1.8255861 ] [ 0.3163838 -0.9488873 -1.1695693 ] [ 0.8301372 0.9700732 0.7553045 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.958823659735231e-09 -1.556408843450227e-09 -1.285163545902029e-10 ] [ 2.351924623345423e-09 8.293529490381811e-10 4.114438749036659e-09 ] [ 4.455017118326342e-10 7.456653360803001e-10 -1.294613504046831e-09 ] [ 1.532513340456968e-09 -1.282797131033107e-10 -2.987526994500908e-09 ] [ -2.024543543098931e-09 -1.017189893013504e-09 -1.964967726978117e-09 ] [ -1.835014540394381e-10 1.092916450560292e-09 2.924911368677451e-09 ] [ 5.06902727559863e-10 -1.520285047834036e-09 -1.873856588865422e-09 ] [ 1.330026413896374e-09 1.554228601504642e-09 1.210131211485034e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.985558 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.682692364364241e-18 } }