{ "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" [ [ 2.690681 1.842727 3.696963 ] [ 2.658202 3.646198 2.018485 ] [ 5.329976 0.2810446 1.792372 ] [ 5.111587 2.700534 2.069297 ] [ 3.393505 1.493232 0.8693091 ] [ 5.014849 1.504764 3.993476 ] [ 3.843884 3.656776 4.040771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.690681e-10 1.842727e-10 3.696963e-10 ] [ 2.658202e-10 3.646198e-10 2.018485e-10 ] [ 5.329976000000001e-10 2.810446e-11 1.792372e-10 ] [ 5.111587e-10 2.700534e-10 2.069297e-10 ] [ 3.393505e-10 1.493232e-10 8.693091e-11 ] [ 5.014849e-10 1.504764e-10 3.993476e-10 ] [ 3.843884e-10 3.656776e-10 4.040771000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5333824 -4.7368762 0.0651698 ] [ -1.7476873 0.7103681 -2.7703745 ] [ 0.4924878 -1.5553632 -0.0279496 ] [ 2.2705233 3.4739104 -2.9198041 ] [ -1.386082 -0.4137177 -1.1673248 ] [ 2.2173807 -3.641018 3.2520166 ] [ 2.6867599 6.1626966 3.5682666 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.263279294426193e-09 -7.589312303263945e-09 1.044135299422118e-10 ] [ -2.800103732529076e-09 1.138135161982116e-09 -4.43862925476049e-09 ] [ 7.890524391892262e-10 -2.491966555892674e-09 -4.478019568071169e-11 ] [ 3.637779348241664e-09 5.565818025633976e-09 -4.678041866335986e-09 ] [ -2.220748174911706e-09 -6.628488265511482e-10 -1.870260503440036e-09 ] [ 3.552635516953139e-09 -5.833553915511974e-09 5.210304966973506e-09 ] [ 4.304663897482946e-09 9.87372841360365e-09 5.716993323301505e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.613872 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.181182743696374e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3227377 1.9258832 4.3767808 ] [ 2.1716775 2.9095253 2.1235144 ] [ 5.3307847 0.6590405 2.0434852 ] [ 5.6746402 3.1200697 1.5814915 ] [ 3.6863063 1.9162011 0.580649 ] [ 4.5792294 1.0075922 4.2575461 ] [ 4.2773081 3.5869635 3.5172061 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3227377e-10 1.9258832e-10 4.3767808e-10 ] [ 2.1716775e-10 2.9095253e-10 2.1235144e-10 ] [ 5.3307847e-10 6.590405000000001e-11 2.0434852e-10 ] [ 5.6746402e-10 3.1200697e-10 1.5814915e-10 ] [ 3.6863063e-10 1.9162011e-10 5.80649e-11 ] [ 4.5792294e-10 1.0075922e-10 4.2575461e-10 ] [ 4.2773081e-10 3.5869635e-10 3.5172061e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-05 2.19e-05 -3.04e-05 ] [ 6.95e-05 -1.13e-05 1.09e-05 ] [ -1.9e-05 -2.52e-05 -1.77e-05 ] [ -2.6e-05 -2.77e-05 1.11e-05 ] [ -8.9e-06 1.45e-05 -3.7e-06 ] [ 7.52e-05 -0.0001125 3.74e-05 ] [ -7.18e-05 0.0001403 -7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.04413557952e-14 3.508766799552e-14 -4.870616927232e-14 ] [ 1.113512751456e-13 -1.810459581504e-14 1.746372516672e-14 ] [ -3.04413557952e-14 -4.037485084416e-14 -2.835852618816e-14 ] [ -4.16565921408e-14 -4.438029239616e-14 1.778416049088e-14 ] [ -1.425937192512e-14 2.32315610016e-14 -5.928053496960001e-15 ] [ 1.2048368188416e-13 -1.8024486984e-13 5.992140561792e-14 ] [ -1.1503628137344e-13 2.2478537989824e-13 -1.217654231808e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.477115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.800142505203299e-18 } }