{ "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" [ 5.51626 0 0 ] "si-unit" "m" "si-value" [ 5.516260000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0156708 5.55287 0 ] "si-unit" "m" "si-value" [ 1.56708e-12 5.55287e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0707378 -0.0779479 5.31818 ] "si-unit" "m" "si-value" [ 7.073780000000001e-12 -7.79479e-12 5.31818e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0442334 -0.0178769 0.0866315 ] [ 1.37385 1.41168 1.32363 ] [ 0.027051 2.64271 2.7677 ] [ 1.3087 3.96384 4.18589 ] [ 2.72942 0.00808237 2.56914 ] [ 4.1019 1.31789 4.05807 ] [ 2.73169 2.7615 0.0742825 ] [ 4.00667 4.08894 1.33622 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.42334e-12 -1.78769e-12 8.66315e-12 ] [ 1.37385e-10 1.41168e-10 1.32363e-10 ] [ 2.7051e-12 2.64271e-10 2.7677e-10 ] [ 1.3087e-10 3.96384e-10 4.18589e-10 ] [ 2.72942e-10 8.082370000000001e-13 2.56914e-10 ] [ 4.1019e-10 1.31789e-10 4.05807e-10 ] [ 2.73169e-10 2.7615e-10 7.42825e-12 ] [ 4.00667e-10 4.08894e-10 1.33622e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.449828 -0.0732244 -0.1126478 ] [ 0.1054844 -0.8221973 0.9697561 ] [ -1.0721822 0.7841049 -0.171846 ] [ 0.4054021 -0.3478829 -0.8604945 ] [ 0.7271629 0.6618304 0.803208 ] [ 0.8710848 -1.0913009 -0.7099644 ] [ -1.0168589 -0.3166317 -0.9110189 ] [ 2.4297349 1.2053018 0.9930074 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.925057146581222e-09 -1.173184217521075e-10 -1.804816715445543e-10 ] [ 1.690046395391155e-10 -1.317305291744884e-09 1.553720551298187e-09 ] [ -1.71782525407791e-09 1.256274539034722e-09 -2.753276435779968e-10 ] [ 6.495257666432236e-10 -5.573698491561043e-10 -1.378664170226986e-09 ] [ 1.165043397893128e-09 1.060369193814712e-09 1.286881079239527e-09 ] [ 1.395631701294244e-09 -1.748456788237999e-09 -1.1374883632803e-09 ] [ -1.629187556232405e-09 -5.072999071441594e-10 -1.459613182686933e-09 ] [ 3.892864451521827e-09 1.931106364968157e-09 1.590973240561394e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.958256 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.921365370874132e-18 } }