{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.8702e-11 6.939902e-11 7.738664e-11 ] [ 2.2922343e-10 2.6882362e-10 4.456553e-11 ] [ 1.9083203e-10 1.8121202e-10 2.7131941e-10 ] ] "source-value" [ [ 0.88702 0.6939902 0.7738664 ] [ 2.2922343 2.6882362 0.4456553 ] [ 1.9083203 1.8121202 2.7131941 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.08082542413632e-12 5.03660242514688e-12 -5.087391424026239e-12 ] [ -5.39661151184064e-12 -7.88943811614336e-12 2.77769360748096e-12 ] [ 2.31578608770432e-12 2.85283569099648e-12 2.30985803420736e-12 ] ] "source-value" [ [ 0.0019229 0.0031436 -0.0031753 ] [ -0.0033683 -0.0049242 0.0017337 ] [ 0.0014454 0.0017806 0.0014417 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.250700758832153e-18 "source-value" -7.8062602 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.494155469760733e-09 -1.751297287169015e-09 -2.078029165448759e-09 ] [ 3.014086756996896e-10 3.692922582523373e-10 3.139276031616346e-10 ] [ 1.192746633843381e-09 1.382005028916678e-09 1.764101402069462e-09 ] ] "source-value" [ [ -0.9325785 -1.0930738 -1.2970038 ] [ 0.1881245 0.2304941 0.1959382 ] [ 0.7444539 0.8625797 1.1010655 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.207391281180505e-18 "source-value" -7.5359437 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 9.494976000000001e-11 7.633406e-11 8.86263e-11 ] [ 2.303045e-10 2.715974e-10 3.616398e-11 ] [ 1.835032e-10 1.715032e-10 2.684813e-10 ] ] "source-value" [ [ 0.9494976 0.7633406 0.886263 ] [ 2.303045 2.715974 0.3616398 ] [ 1.835032 1.715032 2.684813 ] ] } "instance-id" 1 }