{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.203026 0.2649124 0.0761432 ] [ 0.4390709 0.810708 2.186548 ] [ 0.3000789 2.890506 0.2564829 ] [ 2.996181 0.8499925 2.546793 ] [ 2.861384 1.542152 0.2554234 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.203026e-10 2.649124e-11 7.61432e-12 ] [ 4.390709e-11 8.107080000000001e-11 2.186548e-10 ] [ 3.000789e-11 2.890506e-10 2.564829e-11 ] [ 2.996181e-10 8.499925000000001e-11 2.546793e-10 ] [ 2.861384e-10 1.542152e-10 2.554234e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5904839 -0.1269948 0.6424581 ] [ 2.4280138 2.5020564 -1.8113899 ] [ 3.1998653 -5.320381 1.6129908 ] [ -2.7207029 -0.3452135 -1.9918266 ] [ -0.3166923 3.2905329 1.5477675 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.150412741138805e-09 -2.034680995231718e-10 1.029331347663588e-09 ] [ 3.890106945339767e-09 4.008736268003013e-09 -2.90216654893325e-09 ] [ 5.126749373369178e-09 -8.524190051948526e-09 2.584296149325489e-09 ] [ -4.35904657852276e-09 -5.530929988845408e-10 -3.191258011207553e-09 ] [ -5.073969990473798e-10 5.272014882353225e-09 2.479796902934064e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.958124 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.076120332222738e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2817722 0.1504265 0.2464816 ] [ 0.7816347 1.5142034 2.2213097 ] [ 0.3180242 2.3547083 0.0018183 ] [ 2.8018725 0.1886012 2.1267388 ] [ 2.6164373 2.1503315 0.7250421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2817722e-10 1.504265e-11 2.464816e-11 ] [ 7.816347e-11 1.5142034e-10 2.2213097e-10 ] [ 3.180242e-11 2.3547083e-10 1.8183e-13 ] [ 2.8018725e-10 1.886012e-11 2.1267388e-10 ] [ 2.6164373e-10 2.1503315e-10 7.250421000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.9e-06 4.9e-06 4.3e-06 ] [ 6.5e-06 2.7e-06 -4.6e-06 ] [ 2.2e-06 -5.6e-06 3e-07 ] [ -4.5e-06 -4e-07 -5.6e-06 ] [ -6e-06 -1.6e-06 5.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.04413557952e-15 7.850665441919999e-15 6.889359469440001e-15 ] [ 1.04141480352e-14 4.32587687616e-15 -7.370012455680001e-15 ] [ 3.52478856576e-15 -8.972189076479999e-15 4.8065298624e-16 ] [ -7.2097947936e-15 -6.408706483200001e-16 -8.972189076479999e-15 ] [ -9.6130597248e-15 -2.56348259328e-15 8.8119714144e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }