{ "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" [ 5.46308 0 0 ] "si-unit" "m" "si-value" [ 5.46308e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0404011 5.38219 0 ] "si-unit" "m" "si-value" [ -4.04011e-12 5.38219e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0107061 -0.144189 5.56456 ] "si-unit" "m" "si-value" [ 1.07061e-12 -1.44189e-11 5.56456e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0957934 0.00987827 -0.0909378 ] [ 1.38627 1.24986 1.3117 ] [ -0.0751597 2.80438 2.76133 ] [ 1.36904 3.93592 4.18176 ] [ 2.71956 -0.067532 2.7564 ] [ 4.08015 1.26891 4.08099 ] [ 2.56948 2.74723 0.13466 ] [ 4.07358 4.09238 1.48906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.579340000000001e-12 9.87827e-13 -9.09378e-12 ] [ 1.38627e-10 1.24986e-10 1.3117e-10 ] [ -7.51597e-12 2.80438e-10 2.76133e-10 ] [ 1.36904e-10 3.93592e-10 4.18176e-10 ] [ 2.71956e-10 -6.7532e-12 2.7564e-10 ] [ 4.08015e-10 1.26891e-10 4.08099e-10 ] [ 2.56948e-10 2.74723e-10 1.3466e-11 ] [ 4.07358e-10 4.092380000000001e-10 1.48906e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4740988 0.1236936 0.538913 ] [ -1.5753269 0.1991938 1.2747451 ] [ 0.9822938 -2.3706278 0.2828618 ] [ -0.3051886 0.5306028 0.0901733 ] [ -0.8194359 0.6170129 0.5742626 ] [ -0.3326902 0.9234948 0.942188 ] [ 2.0300739 0.2561395 -1.5359247 ] [ -0.453825 -0.2795096 -2.167219 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.595900195674391e-10 1.981789956953424e-10 8.634338163588419e-10 ] [ -2.523951950091654e-09 3.191436519976692e-10 2.042366813525993e-09 ] [ 1.573808174083069e-09 -3.798164469070825e-09 4.531945666111812e-10 ] [ -4.889660438831724e-10 8.501194080949751e-10 1.444735542706722e-10 ] [ -1.31288105204076e-09 9.885636512565784e-10 9.200701195000883e-10 ] [ -5.330284648007867e-10 1.479601790180503e-09 1.509551598435192e-09 ] [ 3.252536967873252e-09 4.10380721944443e-10 -2.46082266592346e-09 ] [ -7.271078109250499e-10 -4.478237500986864e-10 -3.472267642560846e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.182237 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.797033468725025e-18 } }