{ "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" [ [ 0.4128063 0.139585 0.3825707 ] [ -1.5336853 0.2519134 1.0831195 ] [ 1.1011814 -2.258333 0.1836604 ] [ -0.2894139 0.3291762 0.139755 ] [ -0.6518242 0.6074069 0.5524484 ] [ -0.419599 1.0351586 0.8787067 ] [ 1.8483926 0.0857987 -1.3010296 ] [ -0.467858 -0.1907059 -1.9192311 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.613886082279942e-10 2.236398254568899e-10 6.129458363930236e-10 ] [ -2.45723475156928e-09 4.036097632714955e-10 1.735348754729763e-09 ] [ 1.764287108875407e-09 -3.618248364391121e-09 2.942564014710936e-10 ] [ -4.636921881348125e-10 5.273984161089107e-10 2.2391219548467e-10 ] [ -1.044337502715743e-09 9.731731425103744e-10 8.851199179706854e-10 ] [ -6.722717134497659e-10 1.658506921404152e-09 1.407843342879248e-09 ] [ 2.961451434178508e-09 1.374646723675758e-10 -2.084479225262366e-09 ] [ -7.495911556299719e-10 -3.055445369459406e-10 -3.074947223666117e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.00368007419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.166248861287886e-18 } }