{ "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" [ 5.5048 0 0 ] "si-unit" "m" "si-value" [ 5.5048e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0192448 5.36034 0 ] "si-unit" "m" "si-value" [ 1.92448e-12 5.36034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.190348 0.0157222 5.58687 ] "si-unit" "m" "si-value" [ 1.90348e-11 1.57222e-12 5.58687e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0113409 -0.0687251 -0.0764128 ] [ 1.39555 1.34846 1.39039 ] [ 0.152538 2.8802 2.74744 ] [ 1.52254 4.15487 3.86439 ] [ 2.76536 0.0171046 2.52424 ] [ 4.13989 1.28016 4.0502 ] [ 2.78466 2.66896 -0.17742 ] [ 4.2307 4.05829 1.13615 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.13409e-12 -6.87251e-12 -7.641280000000001e-12 ] [ 1.39555e-10 1.34846e-10 1.39039e-10 ] [ 1.52538e-11 2.8802e-10 2.74744e-10 ] [ 1.52254e-10 4.15487e-10 3.864390000000001e-10 ] [ 2.76536e-10 1.71046e-12 2.52424e-10 ] [ 4.13989e-10 1.28016e-10 4.0502e-10 ] [ 2.78466e-10 2.66896e-10 -1.7742e-11 ] [ 4.2307e-10 4.058290000000001e-10 1.13615e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5293214 3.1800107 -2.2460092 ] [ -1.0035809 1.2582156 -2.4415323 ] [ -2.9351228 -2.7821337 -1.6869696 ] [ 1.0481311 -1.0544627 4.1688017 ] [ 2.5811329 0.3597987 0.2617319 ] [ 2.3768638 -0.0670021 -0.7220353 ] [ -1.9799757 1.1736047 0.3080177 ] [ -1.6167698 -2.0680312 2.3579952 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.450242992769125e-09 5.094938797433842e-09 -3.598503430341711e-09 ] [ -1.607913855061423e-09 2.015883618245844e-09 -3.911765969988051e-09 ] [ -4.702585129337034e-09 -4.457469570079801e-09 -2.702823253120328e-09 ] [ 1.679291143953387e-09 -1.689435485445644e-09 6.679156620491296e-09 ] [ 4.135430787557704e-09 5.76461065334233e-10 4.193407310975635e-10 ] [ 3.808155611185848e-09 -1.073491981645037e-10 -1.156828077052314e-09 ] [ -3.172270776292115e-09 1.880322012400998e-09 4.934987577325882e-10 ] [ -2.590350774775492e-09 -3.313351239724969e-09 3.77792478139862e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.290207 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.654114459859252e-18 } }