{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.382185 0.3943114 1.075216 ] [ 0.9807846 1.486461 2.753824 ] [ 0.491957 1.894504 0.6685531 ] [ 1.794418 2.681383 2.23804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.382185e-10 3.943114e-11 1.075216e-10 ] [ 9.807846e-11 1.486461e-10 2.753824e-10 ] [ 4.91957e-11 1.894504e-10 6.685531000000001e-11 ] [ 1.794418e-10 2.681383e-10 2.23804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 9.8393758 -21.0872182 -1.7777668 ] [ -22.0136379 -31.2186723 25.4988723 ] [ -12.7568535 15.5506217 -13.2363655 ] [ 24.9311155 36.7552687 -10.4847399 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.576441787002529e-08 -3.378544799774825e-08 -2.84829640419443e-09 ] [ -3.526973598213681e-08 -5.001782689147656e-08 4.085369705582472e-08 ] [ -2.043873243267066e-08 2.491484252664515e-08 -2.12069953484637e-08 ] [ 3.994405038456451e-08 5.888843220236202e-08 -1.679840514294893e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 13.12713 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.10319807842023e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7718354 0.6716212 1.0026711 ] [ 1.5958486 1.5816174 2.8312555 ] [ 0.0128274 0.8549764 -1.0540261 ] [ 2.2688333 3.3484444 3.9557325 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.718354e-11 6.716212e-11 1.0026711e-10 ] [ 1.5958486e-10 1.5816174e-10 2.8312555e-10 ] [ 1.28274e-12 8.549764e-11 -1.0540261e-10 ] [ 2.2688333e-10 3.3484444e-10 3.9557325e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.1030654 0.1277372 0.2233764 ] [ -0.1048797 -0.102335 -0.2373383 ] [ -0.0419899 -0.0604916 -0.0880336 ] [ 0.0438042 0.0350893 0.1019955 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.651289742934003e-10 2.046575554464538e-10 3.578884457184691e-10 ] [ -1.680358033365178e-10 -1.63958744489568e-10 -3.802578754804166e-10 ] [ -6.727523608972992e-11 -9.691822727478528e-11 -1.410453757648589e-10 ] [ 7.018206513284737e-11 5.621925610023744e-11 1.634148055268064e-10 ] ] } "relaxed-potential-energy" { "source-value" -8.3774571 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.342216590737497e-18 } }