{ "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" [ [ -1.3532123 -0.5136872 -1.5849406 ] [ 0.6849332 -2.0760481 1.4426567 ] [ 1.2381114 1.1400891 -0.8691705 ] [ -1.317716 1.2401095 2.4143415 ] [ 0.0797667 -0.7979568 -4.757243 ] [ 0.7185509 2.2056172 0.6629165 ] [ -0.0504339 -1.1981236 2.6914395 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.168085110038996e-09 -8.230176222442139e-10 -2.539354774676724e-09 ] [ 1.097383959849731e-09 -3.32619572947626e-09 2.311390836580479e-09 ] [ 1.983673139025957e-09 1.826624101648913e-09 -1.392564654589046e-09 ] [ -2.111213768054093e-09 1.986874448131978e-09 3.868201505927203e-09 ] [ 1.278003418583674e-10 -1.278467729368381e-09 -7.621943514064455e-09 ] [ 1.151245452834799e-09 3.533788312274358e-09 1.062109317842563e-09 ] [ -8.080401547576512e-11 -1.919605620748731e-09 4.312161443197642e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.977511 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.642709065317483e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0191384 2.9466524 2.0427132 ] [ 3.1935658 1.8586447 2.376465 ] [ 1.8823951 2.6005386 4.3139031 ] [ 1.586153 4.8524676 3.4436677 ] [ 3.0597559 4.0186751 1.2662156 ] [ 3.6642213 5.6916903 2.7816587 ] [ 4.0299312 3.6297213 3.8187186 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0191384e-10 2.9466524e-10 2.0427132e-10 ] [ 3.1935658e-10 1.8586447e-10 2.376465e-10 ] [ 1.8823951e-10 2.6005386e-10 4.3139031e-10 ] [ 1.586153e-10 4.8524676e-10 3.443667700000001e-10 ] [ 3.0597559e-10 4.018675100000001e-10 1.2662156e-10 ] [ 3.6642213e-10 5.6916903e-10 2.7816587e-10 ] [ 4.0299312e-10 3.6297213e-10 3.8187186e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.19e-05 -5.2e-06 3.71e-05 ] [ -5.6e-06 1.01e-05 -1.23e-05 ] [ 2.53e-05 -1.8e-06 -4.69e-05 ] [ -9.7e-06 1.17e-05 -4.6e-05 ] [ -3.18e-05 -1.2e-05 4.79e-05 ] [ 2.14e-05 -4.9e-06 8.7e-06 ] [ -1.16e-05 2e-06 1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.906590178752e-14 -8.33131842816e-15 5.944075263168e-14 ] [ -8.972189076479999e-15 1.618198387008e-14 -1.970677243584e-14 ] [ 4.053506850624e-14 -2.88391791744e-15 -7.514208351552e-14 ] [ -1.554111322176e-14 1.874546646336e-14 -7.37001245568e-14 ] [ -5.094921654144e-14 -1.92261194496e-14 7.674426013632e-14 ] [ 3.428657968511999e-14 -7.850665441919999e-15 1.393893660096e-14 ] [ -1.858524880128e-14 3.2043532416e-15 1.858524880128e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.25324 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.16753870730514e-18 } }