{ "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" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9754951 -0.4308501 -0.3824808 ] [ 0.0736279 -0.243786 -2.8125599 ] [ -3.2189812 4.6119225 -2.9628614 ] [ -2.5798023 -2.6689393 2.5095029 ] [ 5.0287197 -6.1373904 -1.1701999 ] [ -1.3665564 1.2520178 6.6590697 ] [ 4.0384873 3.6170253 -1.8404704 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.165092063724958e-09 -6.902979572893422e-10 -6.128017956648807e-10 ] [ 1.179649000186003e-10 -3.905882296783488e-10 -4.506217716379586e-09 ] [ -5.157376421434729e-09 7.389114406441489e-09 -4.747027265750757e-09 ] [ -4.133298931346068e-09 -4.276112148794318e-09 4.020666876209801e-09 ] [ 8.05689713589639e-09 -9.833183411602361e-09 -1.874866921442498e-09 ] [ -2.189464715084613e-09 2.00595364798545e-09 1.066900578961767e-08 ] [ 6.470369935457716e-09 5.795113372502106e-09 -2.948758646154425e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.804681 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.300124189401966e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5034627 0.5613381 2.8133281 ] [ 2.3034148 1.3006827 1.37877 ] [ 2.8584267 3.5429881 2.0918243 ] [ 2.0529455 0.0294407 4.5911369 ] [ 3.9348184 0.4095122 3.0207899 ] [ 2.5787684 2.1236384 5.6784536 ] [ 4.1621673 2.6999659 3.9449272 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.034627e-11 5.613381e-11 2.8133281e-10 ] [ 2.3034148e-10 1.3006827e-10 1.37877e-10 ] [ 2.8584267e-10 3.5429881e-10 2.0918243e-10 ] [ 2.0529455e-10 2.94407e-12 4.591136900000001e-10 ] [ 3.9348184e-10 4.095122e-11 3.0207899e-10 ] [ 2.5787684e-10 2.1236384e-10 5.678453600000001e-10 ] [ 4.1621673e-10 2.6999659e-10 3.9449272e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.2e-06 -3e-06 2e-07 ] [ 5.8e-06 5.6e-06 -2e-06 ] [ -4.9e-06 2.2e-06 2e-07 ] [ -2.1e-06 -1.6e-06 1.2e-06 ] [ -5.5e-06 -2.3e-06 1.4e-06 ] [ 3.3e-06 5.4e-06 1.3e-06 ] [ -1.8e-06 -6.3e-06 -2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.33131842816e-15 -4.8065298624e-15 3.2043532416e-16 ] [ 9.292624400640001e-15 8.972189076479999e-15 -3.2043532416e-15 ] [ -7.850665441919999e-15 3.52478856576e-15 3.2043532416e-16 ] [ -3.36457090368e-15 -2.56348259328e-15 1.92261194496e-15 ] [ -8.8119714144e-15 -3.68500622784e-15 2.24304726912e-15 ] [ 5.28718284864e-15 8.65175375232e-15 2.08282960704e-15 ] [ -2.88391791744e-15 -1.009371271104e-14 -3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.267203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.805204922840762e-18 } }