{ "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" [ 5.40034 0 0 ] "si-unit" "m" "si-value" [ 5.40034e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00680429 5.47714 0 ] "si-unit" "m" "si-value" [ -6.804290000000001e-13 5.477140000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0750519 0.000428382 5.30288 ] "si-unit" "m" "si-value" [ 7.50519e-12 4.28382e-14 5.30288e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0542923 -0.0551564 0.0107349 ] [ 1.38568 1.34449 1.49834 ] [ -0.0627007 2.68919 2.77312 ] [ 1.41517 4.13638 3.9375 ] [ 2.74489 -0.0643812 2.6522 ] [ 4.02561 1.44985 4.00224 ] [ 2.7219 2.73875 0.136559 ] [ 4.01026 4.10579 1.40939 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.429230000000001e-12 -5.51564e-12 1.07349e-12 ] [ 1.38568e-10 1.34449e-10 1.49834e-10 ] [ -6.27007e-12 2.68919e-10 2.77312e-10 ] [ 1.41517e-10 4.13638e-10 3.9375e-10 ] [ 2.74489e-10 -6.43812e-12 2.6522e-10 ] [ 4.025610000000001e-10 1.44985e-10 4.00224e-10 ] [ 2.7219e-10 2.73875e-10 1.36559e-11 ] [ 4.01026e-10 4.10579e-10 1.40939e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4865594 1.1382815 0.2579633 ] [ -1.0824944 -0.1788734 -1.2729631 ] [ 1.3952739 1.2300431 -1.0425213 ] [ -0.5597362 -1.1685206 1.3387737 ] [ 0.1020281 1.4378633 0.8067929 ] [ -0.3711177 -2.0736495 1.0521241 ] [ -1.3013816 0.2385436 -0.6833385 ] [ 1.3308686 -0.623688 -0.4568311 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.795540953104755e-10 1.823728007189155e-09 4.133027682844166e-10 ] [ -1.734347219826924e-09 -2.865867795630067e-10 -2.039511717961092e-09 ] [ 2.235475222192437e-09 1.970746297396356e-09 -1.670303253546023e-09 ] [ -8.967962534554331e-10 -1.872176386243188e-09 2.144951922681913e-09 ] [ 1.634670364846445e-10 2.303710963166337e-09 1.292624722207433e-09 ] [ -5.945961025050682e-10 -3.32235274863361e-09 1.685688635200241e-09 ] [ -2.085043174259297e-09 3.821889789614669e-10 -1.094828968792541e-09 ] [ 2.132286556276827e-09 -9.992583322735104e-10 -7.319241080743468e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.40333703877592 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.788321972742948e-18 } }