{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7425856 -7.6101009 -0.9840435 ] [ -2.0900883 5.0709931 3.8567527 ] [ -4.171088 0.7088031 2.2733326 ] [ 5.0041587 4.7842235 -3.2545188 ] [ 0.7817974 -4.6964143 2.3009175 ] [ 1.3306416 1.2041369 0.730785 ] [ -0.1128358 0.5383587 -4.9232256 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.18975328726274e-09 -1.219272574390904e-08 -1.576611489550205e-09 ] [ -3.348690609667617e-09 8.124626589058116e-09 6.179199008147276e-09 ] [ -6.68281967689943e-09 1.135627755570565e-09 3.642280343022478e-09 ] [ 8.017546075912921e-09 7.66517104038195e-09 -5.214313933314072e-09 ] [ 1.252577516482226e-09 -7.524485193050797e-09 3.686476224889584e-09 ] [ 2.131922862183905e-09 1.929239989422587e-09 1.170846641831328e-09 ] [ -1.807828807492646e-10 8.625457227442809e-10 -7.887876955244053e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.786175 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.849659375845744e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.61541 0.5540649 2.0210066 ] [ 1.5281966 2.654466 2.8240689 ] [ 1.3059726 2.3046938 5.2435978 ] [ 3.8678277 2.8346652 1.8647933 ] [ 3.436918 1.1712369 5.7773452 ] [ 4.5057301 1.0703841 3.5697732 ] [ 3.5192931 3.315176 4.27719 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61541e-10 5.540649e-11 2.0210066e-10 ] [ 1.5281966e-10 2.654466000000001e-10 2.8240689e-10 ] [ 1.3059726e-10 2.3046938e-10 5.2435978e-10 ] [ 3.8678277e-10 2.8346652e-10 1.8647933e-10 ] [ 3.436918e-10 1.1712369e-10 5.7773452e-10 ] [ 4.5057301e-10 1.0703841e-10 3.5697732e-10 ] [ 3.5192931e-10 3.315176e-10 4.27719e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.3e-06 0.0001559 0.0001033 ] [ 8.34e-05 -7.71e-05 -2.3e-05 ] [ 2.78e-05 4.3e-05 -3e-06 ] [ -6.06e-05 -9.95e-05 2.54e-05 ] [ -5e-05 -5.06e-05 -5.97e-05 ] [ 3.79e-05 7.58e-05 -2.83e-05 ] [ -4.08e-05 -4.75e-05 -1.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.68500622784e-15 2.4977933518272e-13 1.6550484492864e-13 ] [ 1.3362153017472e-13 -1.2352781746368e-13 -3.68500622784e-14 ] [ 4.454051005824e-14 6.889359469439999e-14 -4.8065298624e-15 ] [ -9.709190322048001e-14 -1.594165737696e-13 4.069528616832e-14 ] [ -8.010883104e-14 -8.107013701248e-14 -9.564994426176e-14 ] [ 6.072249392832e-14 1.2144498785664e-13 -4.534159836864e-14 ] [ -6.536880612864e-14 -7.610338948800001e-14 -2.339177866368e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.198393 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.877009952553038e-18 } }