{ "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" [ [ 2.026325 2.332401 2.957561 ] [ 3.78119 1.739305 1.09586 ] [ 4.095572 1.356929 3.585425 ] [ 3.432411 4.018052 0.5968462 ] [ 4.864307 3.437474 2.341714 ] [ 3.124173 4.42761 2.898506 ] [ 3.279186 3.336979 4.610213 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.026325e-10 2.332401e-10 2.957561e-10 ] [ 3.78119e-10 1.739305e-10 1.09586e-10 ] [ 4.095572e-10 1.356929e-10 3.585425e-10 ] [ 3.432411e-10 4.018052e-10 5.968462e-11 ] [ 4.864307000000001e-10 3.437474e-10 2.341714e-10 ] [ 3.124173e-10 4.42761e-10 2.898506e-10 ] [ 3.279186e-10 3.336979e-10 4.610213e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -36.7196677 -15.5247389 0.7594605 ] [ 0.7056811 -16.9529495 -17.799433 ] [ 10.634114 -23.2006353 11.0424855 ] [ -3.7458878 8.6698184 -20.3106004 ] [ 42.6072055 10.6283296 -7.6546356 ] [ -10.3790905 32.6409027 2.7748779 ] [ -3.1023546 3.739273 31.1878451 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.883139311248491e-08 -2.487337370960431e-08 1.216789857521078e-09 ] [ 1.130625760160427e-09 -2.716161934250305e-08 -2.851783541609601e-08 ] [ 1.703772883372197e-08 -3.717151546536719e-08 1.7692012103623e-08 ] [ -6.001573857299946e-09 1.389058034706167e-08 -3.254116911529113e-08 ] [ 6.826426852972117e-08 1.702846120327662e-08 -1.226407819906338e-08 ] [ -1.662913614426738e-08 5.229649118774759e-08 4.4458444969546e-09 ] [ -4.970520009551336e-09 5.990975779388678e-09 4.996843627235184e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 20.337832 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.25847989481581e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6151144 1.7341696 3.253718 ] [ 3.0984833 1.5958787 1.4168416 ] [ 5.2382231 1.3593532 2.3962247 ] [ 3.1619431 3.8480034 0.7006088 ] [ 5.6796488 3.4900901 3.3297548 ] [ 3.7532042 4.7563912 2.8016387 ] [ 2.0565472 3.8648638 4.1873386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6151144e-10 1.7341696e-10 3.253718e-10 ] [ 3.0984833e-10 1.5958787e-10 1.4168416e-10 ] [ 5.2382231e-10 1.3593532e-10 2.3962247e-10 ] [ 3.1619431e-10 3.8480034e-10 7.006088e-11 ] [ 5.6796488e-10 3.490090100000001e-10 3.3297548e-10 ] [ 3.7532042e-10 4.7563912e-10 2.8016387e-10 ] [ 2.0565472e-10 3.8648638e-10 4.1873386e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.83e-05 -1.9e-05 2e-06 ] [ -2e-05 3e-05 1.9e-05 ] [ 3.23e-05 -7.7e-06 -1.74e-05 ] [ 2.8e-06 -1.01e-05 2.4e-05 ] [ -4.26e-05 -2.7e-05 1.18e-05 ] [ -1.7e-06 2e-05 -1.39e-05 ] [ 1.09e-05 1.38e-05 -2.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.931983216064e-14 -3.04413557952e-14 3.2043532416e-15 ] [ -3.2043532416e-14 4.8065298624e-14 3.04413557952e-14 ] [ 5.175030485184e-14 -1.233675998016e-14 -2.787787320192e-14 ] [ 4.48609453824e-15 -1.618198387008e-14 3.84522388992e-14 ] [ -6.825272404608e-14 -4.32587687616e-14 1.890568412544e-14 ] [ -2.72370025536e-15 3.2043532416e-14 -2.227025502912e-14 ] [ 1.746372516672e-14 2.211003736704e-14 -4.101572149248001e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }