{ "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" [ 5.39006 0 0 ] "si-unit" "m" "si-value" [ 5.39006e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.23331 5.36322 0 ] "si-unit" "m" "si-value" [ 2.3331e-11 5.36322e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.160148 -0.0213292 5.4933 ] "si-unit" "m" "si-value" [ -1.60148e-11 -2.13292e-12 5.4933e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.105355 0.0424721 -0.0304949 ] [ 1.33629 1.36991 1.45967 ] [ -0.05353 2.71357 2.83859 ] [ 1.26119 4.17265 4.20892 ] [ 2.69817 -0.0783338 2.63037 ] [ 3.99124 1.24872 4.05842 ] [ 2.76699 2.61469 0.0747626 ] [ 4.02836 3.96527 1.47431 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.05355e-11 4.24721e-12 -3.04949e-12 ] [ 1.33629e-10 1.36991e-10 1.45967e-10 ] [ -5.353e-12 2.71357e-10 2.83859e-10 ] [ 1.26119e-10 4.17265e-10 4.20892e-10 ] [ 2.69817e-10 -7.83338e-12 2.63037e-10 ] [ 3.99124e-10 1.24872e-10 4.05842e-10 ] [ 2.76699e-10 2.61469e-10 7.47626e-12 ] [ 4.02836e-10 3.96527e-10 1.47431e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.762802 0.1047532 1.1684571 ] [ -0.300668 0.3617182 0.1084806 ] [ 0.4679794 -0.0888339 0.2282802 ] [ 0.900619 -0.601831 -0.6909896 ] [ -0.6206776 0.1711304 0.7728745 ] [ -0.4760424 0.3074652 0.2167284 ] [ 0.0572284 -0.1445742 -0.6075923 ] [ 0.7343632 -0.1098278 -1.1962388 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.222143530699482e-09 1.678331279939866e-10 1.872074648027768e-09 ] [ -4.817232402226944e-10 5.795364433578585e-10 1.738050811303565e-10 ] [ 7.497856536960115e-10 -1.423275977144851e-10 3.657451994315482e-10 ] [ 1.442950706048275e-09 -9.642395578726847e-10 -1.107087382335944e-09 ] [ -9.944351397742541e-10 2.741811259881523e-10 1.23828145471249e-09 ] [ -7.627040037895219e-10 4.926135551495962e-10 3.472371755433907e-10 ] [ 9.169000452579071e-11 -2.316334032108634e-10 -9.734701780380998e-10 ] [ 1.176579550215875e-09 -1.759635334738982e-10 -1.916585838253847e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 153.19519 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.45445751837014e-17 } }