{ "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" [ 5.44038 0 0 ] "si-unit" "m" "si-value" [ 5.44038e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0177809 5.34742 0 ] "si-unit" "m" "si-value" [ 1.77809e-12 5.34742e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.258508 -0.216411 5.45927 ] "si-unit" "m" "si-value" [ 2.58508e-11 -2.16411e-11 5.459270000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0111666 -0.0485116 -0.0844937 ] [ 1.40892 1.32935 1.34318 ] [ 0.251238 2.67562 2.78628 ] [ 1.4893 4.10816 4.17197 ] [ 2.79244 -0.0558727 2.81547 ] [ 4.18247 1.3542 3.88471 ] [ 2.61313 2.71504 -0.144964 ] [ 4.08224 4.0407 1.29994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.11666e-12 -4.851160000000001e-12 -8.44937e-12 ] [ 1.40892e-10 1.32935e-10 1.34318e-10 ] [ 2.51238e-11 2.67562e-10 2.78628e-10 ] [ 1.4893e-10 4.10816e-10 4.17197e-10 ] [ 2.79244e-10 -5.58727e-12 2.81547e-10 ] [ 4.182470000000001e-10 1.3542e-10 3.88471e-10 ] [ 2.61313e-10 2.71504e-10 -1.44964e-11 ] [ 4.08224e-10 4.0407e-10 1.29994e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5183129 5.1077975 3.7610081 ] [ 0.2289171 -0.8178331 -0.4865648 ] [ -1.319051 1.1364368 -0.9969994 ] [ 3.9249571 -4.9734451 -3.4962561 ] [ -0.1703769 0.9625155 -1.9254085 ] [ 1.4574689 -1.2306391 1.6090397 ] [ -0.062392 1.0625945 1.1376246 ] [ 0.4587897 -1.2474271 0.3975563 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.239135353480777e-09 8.183593805703614e-09 6.025799298104735e-09 ] [ 3.667656287430414e-10 -1.310313083331785e-09 -7.795627534868832e-10 ] [ -2.113352691254334e-09 1.820772486977731e-09 -1.597369142792019e-09 ] [ 6.2884745550724e-09 -7.968337529701793e-09 -5.601619829899967e-09 ] [ -2.729738881533545e-10 1.542119843962827e-09 -3.084844509604989e-09 ] [ 2.335122616361683e-09 -1.971701210906789e-09 2.57796581051837e-09 ] [ -9.9963004548528e-11 1.702464079316913e-09 1.822675552383596e-09 ] [ 7.350621372598698e-10 -1.998598552238381e-09 6.36955414559494e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.890807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.590123571680364e-18 } }