{ "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" [ 5.43593 0 0 ] "si-unit" "m" "si-value" [ 5.43593e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00214695 5.43123 0 ] "si-unit" "m" "si-value" [ 2.14695e-13 5.43123e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0452237 0.0446124 5.47348 ] "si-unit" "m" "si-value" [ -4.52237e-12 4.461240000000001e-12 5.473480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0488145 -0.0723712 0.108622 ] [ 1.36095 1.35641 1.2952 ] [ -0.00863748 2.68477 2.74572 ] [ 1.30162 4.04466 3.93872 ] [ 2.7765 -0.0432881 2.8136 ] [ 4.0674 1.36091 4.19847 ] [ 2.70508 2.80909 0.166723 ] [ 4.1715 4.08924 1.48814 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.88145e-12 -7.23712e-12 1.08622e-11 ] [ 1.36095e-10 1.35641e-10 1.2952e-10 ] [ -8.63748e-13 2.68477e-10 2.74572e-10 ] [ 1.30162e-10 4.044660000000001e-10 3.93872e-10 ] [ 2.7765e-10 -4.328810000000001e-12 2.8136e-10 ] [ 4.0674e-10 1.36091e-10 4.19847e-10 ] [ 2.70508e-10 2.80909e-10 1.66723e-11 ] [ 4.1715e-10 4.089240000000001e-10 1.48814e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.515879 0.3519874 -1.7328236 ] [ 0.0642084 -0.6267253 1.8393665 ] [ -0.0250103 -1.3642314 -0.028815 ] [ 0.5816978 0.7114594 3.1649168 ] [ -0.606922 1.1355176 -0.8049258 ] [ -0.4936575 0.641203 0.0544727 ] [ 0.4249809 -0.4324652 -2.1377565 ] [ -1.4611763 -0.4167455 -0.3544351 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.428705913771286e-09 5.639459877424115e-10 -2.776289482763762e-09 ] [ 1.028731981865256e-10 -1.00412463159664e-09 2.946990027662361e-09 ] [ -4.00709182693302e-11 -2.185739672449107e-09 -4.616671970871e-11 ] [ 9.319826232092052e-10 1.139883626719659e-09 5.070755745514051e-09 ] [ -9.723962470605478e-10 1.819299766215758e-09 -1.289633308863757e-09 ] [ -7.90926511698855e-10 1.027320464250702e-09 8.727488713089179e-11 ] [ 6.808944678762905e-10 -6.928856384581368e-10 -3.425063513481621e-09 ] [ -2.341062526014574e-09 -6.676999024246469e-10 -5.678676354894534e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.128016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.788346306797815e-18 } }