{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.5286717 0.5459164 0.2171681 ] [ 0.0530602 2.45185 0.0097729 ] [ 0.1982568 1.952172 2.366336 ] [ 2.940741 0.007829 0.5912968 ] [ 2.574768 0.9414562 2.330693 ] [ 2.158325 2.742494 1.504322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.286717e-11 5.459164e-11 2.171681e-11 ] [ 5.30602e-12 2.45185e-10 9.7729e-13 ] [ 1.982568e-11 1.952172e-10 2.366336e-10 ] [ 2.940741e-10 7.828999999999999e-13 5.912968e-11 ] [ 2.574768e-10 9.414562e-11 2.330693e-10 ] [ 2.158325e-10 2.742494e-10 1.504322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3503194 -5.3014495 -0.5692395 ] [ -0.5696735 3.9921573 -0.8133322 ] [ -0.3046016 -0.8654237 0.6057754 ] [ -0.6985396 -1.0822036 -2.9549322 ] [ 0.4906861 -1.0114293 4.900063 ] [ 0.7318093 4.2683487 -1.1683346 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.612735571168995e-10 -8.493858515230984e-09 -9.12022226049843e-10 ] [ -9.12717570708999e-10 6.396141145312528e-09 -1.303101846519815e-09 ] [ -4.880255661990142e-10 -1.386561630649826e-09 9.705591913320035e-10 ] [ -1.119183825043706e-09 -1.733881321150682e-09 -4.734323325894214e-09 ] [ 7.861658040485873e-10 -1.620488391402976e-09 7.850766443727942e-09 ] [ 1.172487761003896e-09 6.838648552904275e-09 -1.871878396813736e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.064452719227608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.093156088274424e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3148669 0.23878 0.1106186 ] [ 0.3418068 2.6585044 0.3355305 ] [ 0.1417534 1.2783558 2.3197873 ] [ 2.6156762 0.3939866 0.5348332 ] [ 2.4349745 1.2820534 2.8085543 ] [ 2.6047449 2.7900374 0.9102648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.148669e-11 2.3878e-11 1.106186e-11 ] [ 3.418068e-11 2.6585044e-10 3.355305e-11 ] [ 1.417534e-11 1.2783558e-10 2.3197873e-10 ] [ 2.6156762e-10 3.939866e-11 5.348332e-11 ] [ 2.4349745e-10 1.2820534e-10 2.8085543e-10 ] [ 2.6047449e-10 2.7900374e-10 9.102648e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.2e-06 1.74e-05 -1.17e-05 ] [ 2.37e-05 -2.79e-05 8.5e-06 ] [ 3.51e-05 -3e-07 -2.05e-05 ] [ -3.45e-05 3.1e-05 2.22e-05 ] [ 3.1e-06 -3.7e-06 1.56e-05 ] [ -2.63e-05 -1.66e-05 -1.41e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.9226119608e-15 2.78778734316e-14 -1.87454666178e-14 ] [ 3.79715862258e-14 -4.470072808859999e-14 1.3618501389e-14 ] [ 5.62363998534e-14 -4.806529901999999e-16 -3.2844620997e-14 ] [ -5.527509387299999e-14 4.966747565399999e-14 3.55683212748e-14 ] [ 4.9667475654e-15 -5.9280535458e-15 2.49939554904e-14 ] [ -4.21372454742e-14 -2.65961321244e-14 -2.25906905394e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.509304719227607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.64508222647324e-18 } }