{ "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" [ 5.41852 0 0 ] "si-unit" "m" "si-value" [ 5.418520000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038783 5.47951 0 ] "si-unit" "m" "si-value" [ 3.8783e-12 5.479510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00323821 0.0198894 5.39896 ] "si-unit" "m" "si-value" [ 3.23821e-13 1.98894e-12 5.39896e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0136142 -0.0297439 -0.141562 ] [ 1.34075 1.30471 1.3715 ] [ -0.0280615 2.73239 2.73273 ] [ 1.33689 4.08129 3.93514 ] [ 2.80172 0.157681 2.72105 ] [ 4.07194 1.39009 4.01929 ] [ 2.65272 2.79754 0.0144035 ] [ 4.02421 4.07244 1.32124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.36142e-12 -2.97439e-12 -1.41562e-11 ] [ 1.34075e-10 1.30471e-10 1.3715e-10 ] [ -2.80615e-12 2.73239e-10 2.73273e-10 ] [ 1.33689e-10 4.08129e-10 3.93514e-10 ] [ 2.80172e-10 1.57681e-11 2.72105e-10 ] [ 4.07194e-10 1.39009e-10 4.01929e-10 ] [ 2.65272e-10 2.79754e-10 1.44035e-12 ] [ 4.02421e-10 4.072440000000001e-10 1.32124e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0412658 -0.2220898 1.6842644 ] [ -0.553927 0.9667148 -0.8668012 ] [ 0.0748896 -0.2210603 -1.5836302 ] [ 1.18295 1.0989875 0.5174177 ] [ -1.5633816 -2.8094321 -0.9713089 ] [ -0.0159752 1.3463715 1.5557331 ] [ -0.0335697 -1.327062 -0.635977 ] [ 0.9502797 1.1675704 0.3003021 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.611509999860865e-11 -3.558270852781478e-10 2.698489044925739e-09 ] [ -8.874888890298815e-10 1.548847851541348e-09 -1.388768617521385e-09 ] [ 1.199863662610637e-10 -3.541776444470342e-10 -2.537255282432828e-09 ] [ 1.89529483357536e-09 1.76077207905144e-09 8.289945421281081e-10 ] [ -2.504813448908898e-09 -4.501206428345048e-09 -1.556208411154965e-09 ] [ -2.559509195260416e-11 2.157124940211428e-09 2.492559201024709e-09 ] [ -5.378458850726976e-11 -2.12618771075209e-09 -1.018947480766522e-09 ] [ 1.522515918560838e-09 1.870653998018104e-09 4.811370037971437e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.373688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.827707252587351e-18 } }