{ "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" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.5960636 -0.759545 -6.6432944 ] [ 2.77996 -9.8251064 -1.2839144 ] [ 3.6971364 -2.1243928 6.1194508 ] [ -9.9769574 4.7829639 6.5023185 ] [ 4.7334132 -6.6317546 -21.5637082 ] [ 4.5385378 22.5004271 -1.8318898 ] [ 5.8239736 -7.9425921 18.7010375 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.857894199322988e-08 -1.216925241445536e-09 -1.064373097277156e-08 ] [ 4.453986918759168e-09 -1.574155577095245e-08 -2.05705763478846e-09 ] [ 5.923465503988677e-09 -3.40365247755585e-09 9.804441003895857e-09 ] [ -1.598484789299755e-08 7.66315293871039e-09 1.041786268169533e-08 ] [ 7.583763965626115e-09 -1.062524217500286e-08 -3.454886913579325e-08 ] [ 7.271539155777067e-09 3.604965825763474e-08 -2.935011009441988e-09 ] [ 9.331034342076412e-09 -1.272543537117078e-08 2.996236506720408e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.841 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.73691967460928e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4370401 3.0814926 2.2981808 ] [ 2.6288788 1.8344656 1.682034 ] [ 2.221554 2.2772978 4.2300114 ] [ 1.4495153 4.8895069 3.831613 ] [ 4.4159022 3.5969467 1.6237977 ] [ 3.2193307 5.8254415 2.2076644 ] [ 4.0629397 4.0932388 4.1700407 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.370401e-11 3.0814926e-10 2.2981808e-10 ] [ 2.6288788e-10 1.8344656e-10 1.682034e-10 ] [ 2.221554e-10 2.2772978e-10 4.230011400000001e-10 ] [ 1.4495153e-10 4.8895069e-10 3.831613e-10 ] [ 4.4159022e-10 3.5969467e-10 1.6237977e-10 ] [ 3.2193307e-10 5.8254415e-10 2.2076644e-10 ] [ 4.062939700000001e-10 4.0932388e-10 4.1700407e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.4e-06 1.73e-05 5.43e-05 ] [ -1.02e-05 3.4e-06 -1.97e-05 ] [ -2.78e-05 -5.05e-05 -1.7e-05 ] [ -1.66e-05 3.64e-05 -4.12e-05 ] [ 8.18e-05 -3.45e-05 4.7e-06 ] [ -5.83e-05 -5.9e-06 3.35e-05 ] [ 3.56e-05 3.39e-05 -1.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.04957713152e-15 2.771765553984e-14 8.699819050944e-14 ] [ -1.634220153216e-14 5.44740051072e-15 -3.156287942976e-14 ] [ -4.454051005824e-14 -8.090991935040001e-14 -2.72370025536e-14 ] [ -2.659613190528e-14 5.831922899712e-14 -6.600967677696001e-14 ] [ 1.3105804758144e-13 -5.52750934176e-14 7.53023011776e-15 ] [ -9.340689699264e-14 -9.45284206272e-15 5.36729167968e-14 ] [ 5.703748770048e-14 5.431378744512e-14 -2.355199632576e-14 ] ] } "relaxed-potential-energy" { "source-value" -23.737843 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.803221708282094e-18 } }