{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -162.0648078 -209.711976 -87.1703158 ] [ -116.350445 -81.7424694 38.6763052 ] [ -1017.0638829 -344.4536761 -334.6216139 ] [ 475.564199 436.7532688 -226.9251513 ] [ 113.8159244 176.7637776 -157.869002 ] [ 356.4195633 -201.9929896 531.8631675 ] [ 349.6794491 224.3840648 236.0466102 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.596564461116055e-07 -3.359956250489707e-07 -1.396622420025129e-07 ] [ -1.864139627986762e-07 -1.309658733991394e-07 6.196627197036547e-08 ] [ -1.629515975042449e-06 -5.518756267960357e-07 -5.361229266049444e-07 ] [ 7.619378413272787e-07 6.99755876329338e-07 -3.635741720843628e-07 ] [ 1.823532131484203e-07 2.832067918750107e-07 -2.529340241534284e-07 ] [ 5.710470915150057e-07 -3.236284455026175e-07 8.521387324331344e-07 ] [ 5.602482381222436e-07 3.595029027026322e-07 3.781883602815308e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 105.24243 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.686169608621806e-17 } "relaxed-configuration-positions" { "source-value" [ [ 2.9369136 0.748121 1.808143 ] [ 1.579028 2.2631044 3.7603863 ] [ 1.2315658 4.1066301 1.6626216 ] [ 3.1012244 4.7582692 4.1319023 ] [ 4.7063376 2.5713681 3.3829027 ] [ 3.740894 5.7278321 1.5626469 ] [ 3.8836276 3.0892398 0.4523027 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9369136e-10 7.481210000000001e-11 1.808143e-10 ] [ 1.579028e-10 2.2631044e-10 3.7603863e-10 ] [ 1.2315658e-10 4.1066301e-10 1.6626216e-10 ] [ 3.1012244e-10 4.7582692e-10 4.1319023e-10 ] [ 4.706337600000001e-10 2.5713681e-10 3.3829027e-10 ] [ 3.740894e-10 5.7278321e-10 1.5626469e-10 ] [ 3.8836276e-10 3.0892398e-10 4.523027e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.58e-05 -2.56e-05 -1.89e-05 ] [ -5.34e-05 -3.3e-05 -3.47e-05 ] [ 2.46e-05 -4.8e-06 6.15e-05 ] [ 2.91e-05 2.53e-05 -7.74e-05 ] [ 2.84e-05 1.54e-05 1.42e-05 ] [ -1.46e-05 3.25e-05 9.8e-06 ] [ 1.8e-06 -9.8e-06 4.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.531439060864e-14 -4.101572149248001e-14 -3.028113813312e-14 ] [ -8.555623155072e-14 -5.28718284864e-14 -5.559552874176001e-14 ] [ 3.941354487168e-14 -7.69044777984e-15 9.853386217920001e-14 ] [ 4.662333966527999e-14 4.053506850624e-14 -1.2400847044992e-13 ] [ 4.550181603071999e-14 2.467351996032e-14 2.275090801536e-14 ] [ -2.339177866368e-14 5.207074017599999e-14 1.570133088384e-14 ] [ 2.88391791744e-15 -1.570133088384e-14 7.28990362464e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.661456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.989894851328789e-18 } }