{ "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" [ [ -11.883808 -26.9570309 4.791929 ] [ -4.6470717 3.6612526 -12.0750002 ] [ -6.8181017 1.3913808 11.6495782 ] [ 13.5273129 25.1659845 -4.9987855 ] [ 1.3297087 -5.7218315 3.8075915 ] [ 5.3229744 0.8706597 -1.7647579 ] [ 3.1689853 1.5895848 -1.4105551 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.903995934367601e-08 -4.318992467416318e-08 7.677516612333523e-09 ] [ -7.445429632921311e-09 5.865973318563214e-09 -1.934628301659533e-08 ] [ -1.092380314197674e-08 2.229237788390001e-09 1.866468183422135e-08 ] [ 2.167314447062625e-08 4.032035200531518e-08 -8.00893726049404e-09 ] [ 2.130428191614361e-09 -9.167384657456996e-09 6.100434082856804e-09 ] [ 8.528345136796907e-09 1.394950616012742e-09 -2.827453848752104e-09 ] [ 5.077274159318874e-09 2.546795603339044e-09 -2.259958403570206e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.6408749 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.544638436883754e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7589111 0.4109292 2.497806 ] [ 1.1936691 2.3929099 2.7103989 ] [ 1.7196043 2.6855945 5.103965 ] [ 3.5814257 2.8812578 2.0150098 ] [ 2.8137704 0.4745123 5.0308621 ] [ 4.8362095 1.3954345 3.8122296 ] [ 3.8757578 3.6640485 4.4075036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7589111e-10 4.109292e-11 2.497806e-10 ] [ 1.1936691e-10 2.3929099e-10 2.7103989e-10 ] [ 1.7196043e-10 2.6855945e-10 5.103964999999999e-10 ] [ 3.5814257e-10 2.8812578e-10 2.0150098e-10 ] [ 2.8137704e-10 4.745123e-11 5.0308621e-10 ] [ 4.8362095e-10 1.3954345e-10 3.812229600000001e-10 ] [ 3.8757578e-10 3.6640485e-10 4.4075036e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.2e-06 -2.5e-06 -1.38e-05 ] [ 2.07e-05 3.1e-06 9.4e-06 ] [ -7.1e-06 2.7e-06 2e-06 ] [ -5.2e-06 -1.66e-05 -6e-07 ] [ -6.2e-06 3.9e-06 3.6e-06 ] [ 9.7e-06 1.72e-05 -5.9e-06 ] [ -4.6e-06 -7.9e-06 5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.153567166976e-14 -4.005441552e-15 -2.211003736704e-14 ] [ 3.316505605055999e-14 4.96674752448e-15 1.506046023552e-14 ] [ -1.137545400768e-14 4.32587687616e-15 3.2043532416e-15 ] [ -8.33131842816e-15 -2.659613190528e-14 -9.6130597248e-16 ] [ -9.93349504896e-15 6.24848882112e-15 5.76783583488e-15 ] [ 1.554111322176e-14 2.755743787776e-14 -9.45284206272e-15 ] [ -7.370012455680001e-15 -1.265719530432e-14 8.33131842816e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }