{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.569029 2.409456 2.459016 ] [ 1.280031 0.1374919 2.779238 ] [ 3.588101 1.133333 2.932926 ] [ 4.931515 2.722575 2.426382 ] [ 3.330231 3.38172 3.93095 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.569029e-10 2.409456e-10 2.459016e-10 ] [ 1.280031e-10 1.374919e-11 2.779238e-10 ] [ 3.588101e-10 1.133333e-10 2.932926e-10 ] [ 4.931515000000001e-10 2.722575e-10 2.426382e-10 ] [ 3.330231e-10 3.38172e-10 3.93095e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2311925 0.9861827 0.1675168 ] [ 0.176366 -0.2957226 0.1187618 ] [ -1.010455 -2.7809936 0.2980381 ] [ 2.2981395 1.4097477 -1.1555792 ] [ -1.2328581 0.6807858 0.5712626 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.70411218404304e-10 1.58003886577742e-09 2.683915005512294e-10 ] [ 2.825694819040128e-10 -4.737998359621901e-10 1.902773794041255e-10 ] [ -1.618927377370464e-09 -4.455642928514427e-09 4.775096759276524e-10 ] [ 3.682025378237002e-09 2.258664806166572e-09 -1.851441977722767e-09 ] [ -1.975256424583908e-09 1.090739092532625e-09 9.152635820574221e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2925714 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.488834064419473e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1470311 2.7249779 2.72212 ] [ 1.7468186 0.4857383 2.4057253 ] [ 3.771198 0.829743 3.4473062 ] [ 4.8874834 2.5816183 2.1764613 ] [ 3.1463759 3.1624984 3.7768992 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1470311e-10 2.7249779e-10 2.72212e-10 ] [ 1.7468186e-10 4.857383e-11 2.4057253e-10 ] [ 3.771198e-10 8.29743e-11 3.4473062e-10 ] [ 4.8874834e-10 2.5816183e-10 2.1764613e-10 ] [ 3.1463759e-10 3.1624984e-10 3.7768992e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.7e-06 -5e-06 -9.8e-06 ] [ -2.53e-05 -1.93e-05 -1.84e-05 ] [ 1.18e-05 3.4e-05 9.8e-06 ] [ -3.84e-05 1.2e-06 2.05e-05 ] [ 4.72e-05 -1.08e-05 -2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.53023011776e-15 -8.010883104e-15 -1.570133088384e-14 ] [ -4.053506850624e-14 -3.092200878144e-14 -2.948004982272e-14 ] [ 1.890568412544e-14 5.44740051072e-14 1.570133088384e-14 ] [ -6.152358223872e-14 1.92261194496e-15 3.28446207264e-14 ] [ 7.562273650176e-14 -1.730350750464e-14 -3.52478856576e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.457994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.675555348726667e-18 } }