{ "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" [ [ 0.1263174 0.4385011 2.440297 ] [ 1.443642 1.70162 0.7822092 ] [ 0.8295505 2.763862 2.693363 ] [ 2.917075 0.1010564 1.432133 ] [ 1.93191 1.054076 2.887848 ] [ 2.783401 2.698255 1.169851 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.263174e-11 4.385011e-11 2.440297e-10 ] [ 1.443642e-10 1.70162e-10 7.822092e-11 ] [ 8.295505e-11 2.763862e-10 2.693363e-10 ] [ 2.917075e-10 1.010564e-11 1.432133e-10 ] [ 1.93191e-10 1.054076e-10 2.887848e-10 ] [ 2.783401e-10 2.698255e-10 1.169851e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.7199325 -6.2120519 -1.3127568 ] [ -26.2646317 -15.3370201 -18.3329594 ] [ -7.8564426 12.9190047 4.0076128 ] [ 9.7170612 -8.7858117 -7.3930898 ] [ 12.6250323 -2.6913663 18.1821404 ] [ 26.4989133 20.1072453 4.8490528 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.35839317112541e-08 -9.952804321376218e-09 -2.103268253756222e-09 ] [ -4.208057886366256e-08 -2.457261503695968e-08 -2.93726389407556e-08 ] [ -1.258740865637717e-08 2.069852729434532e-08 6.420903533378827e-09 ] [ 1.556844827752279e-08 -1.40764221004911e-08 -1.184503563303495e-08 ] [ 2.022753158790485e-08 -4.312044163868999e-09 2.913100026498316e-08 ] [ 4.245593936586618e-08 3.221535832835068e-08 7.769039029184779e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.8677447 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.100333999596311e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0253525 1.0348234 2.0797975 ] [ 1.5987391 1.1807962 0.2288443 ] [ 1.3409231 2.8922242 3.14694 ] [ 3.0505432 -0.2298348 1.4959285 ] [ 1.9873378 0.467348 3.5228791 ] [ 2.0797052 3.4120135 0.9313118 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.53525e-12 1.0348234e-10 2.0797975e-10 ] [ 1.5987391e-10 1.1807962e-10 2.288443e-11 ] [ 1.3409231e-10 2.8922242e-10 3.14694e-10 ] [ 3.0505432e-10 -2.298348e-11 1.4959285e-10 ] [ 1.9873378e-10 4.67348e-11 3.5228791e-10 ] [ 2.0797052e-10 3.4120135e-10 9.313118e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.5e-06 -3.8e-06 -1.91e-05 ] [ -1.07e-05 1.8e-06 -1.14e-05 ] [ -5.7e-06 -2.7e-06 3.45e-05 ] [ -7.4e-06 1.28e-05 -6.7e-06 ] [ 4.2e-06 2.1e-06 2.58e-05 ] [ 1.12e-05 -1.02e-05 -2.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.36185012768e-14 -6.08827115904e-15 -3.060157345728e-14 ] [ -1.714328984256e-14 2.88391791744e-15 -1.826481347712e-14 ] [ -9.13240673856e-15 -4.32587687616e-15 5.52750934176e-14 ] [ -1.185610699392e-14 2.050786074624e-14 -1.073458335936e-14 ] [ 6.72914180736e-15 3.36457090368e-15 4.133615681664e-14 ] [ 1.794437815296e-14 -1.634220153216e-14 -3.717049760256e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.521764 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.326643077357509e-18 } }