{ "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" [ [ -5.8206183 6.9679208 5.5440933 ] [ 0.4328716 -1.0825137 -0.5376084 ] [ -1.477437 1.3189198 -1.1908344 ] [ 5.2765488 -6.9905359 -4.8571695 ] [ -0.191235 1.2170986 -2.6531189 ] [ 1.5402355 -1.4090567 1.8036468 ] [ -0.1279532 1.6786309 1.5564216 ] [ 0.3675876 -1.7004637 0.3345694 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.32565855886064e-09 1.116383980134603e-08 8.882616668793921e-09 ] [ 6.935367573282893e-10 -1.734378141835705e-09 -8.613436096256947e-10 ] [ -2.367115020104889e-09 2.113142468270212e-09 -1.907927034924395e-09 ] [ 8.453963125870294e-09 -1.120007318584309e-08 -7.782043416162827e-09 ] [ -3.06392246078688e-10 1.950006922128411e-09 -4.250765073782613e-09 ] [ 2.467729308626198e-09 -2.257557702121599e-09 2.889760735140733e-09 ] [ -2.050036255965465e-10 2.689463182932463e-09 2.493662299628129e-09 ] [ 5.889402588159821e-10 -2.724443184659065e-09 5.360392707150836e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.279536 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.492187115107195e-18 } }