{ "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" [ [ 0.7315436 0.3767612 1.166558 ] [ 0.6069044 0.5624824 2.9402 ] [ 2.192795 0.1872249 0.2922769 ] [ 2.54678 0.883358 1.224646 ] [ 2.591807 0.3326772 2.854818 ] [ 2.523994 2.504234 0.7585561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.315436e-11 3.767612e-11 1.166558e-10 ] [ 6.069044000000001e-11 5.624824e-11 2.9402e-10 ] [ 2.192795e-10 1.872249e-11 2.922769e-11 ] [ 2.54678e-10 8.83358e-11 1.224646e-10 ] [ 2.591807e-10 3.326772e-11 2.854818e-10 ] [ 2.523994e-10 2.504234e-10 7.585561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.9225945 2.0059309 -0.8929265 ] [ -9.6712695 2.8115752 14.6160774 ] [ -12.2753817 -73.6091367 -109.014482 ] [ 32.8292114 54.1404197 77.0779304 ] [ 10.3800779 -9.5369269 25.1688417 ] [ -0.3400436 24.1881378 -6.9554409 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.352169175437866e-08 3.213855590920303e-09 -1.430625962392771e-09 ] [ -1.54950818863561e-08 4.504640053061084e-09 2.341753749808325e-08 ] [ -1.966732957113616e-08 -1.179348378980112e-07 -1.746604543890224e-07 ] [ 5.259819498438084e-08 8.674251468363974e-08 1.234924580665296e-07 ] [ 1.663071813346276e-08 -1.527984131345862e-08 4.032492974435613e-08 ] [ -5.448099059726669e-10 3.875366888384875e-08 -1.114384479733611e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 42.027362 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.733525683029833e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3359738 0.9795537 0.8718443 ] [ 0.6404277 0.384857 3.1072605 ] [ 2.0299504 -0.628488 -0.1460593 ] [ 3.5178357 0.8893142 1.2589042 ] [ 2.6540085 0.3277799 3.3522117 ] [ 2.0156279 2.8937209 0.7928935 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.359738e-11 9.795537e-11 8.718443e-11 ] [ 6.404277e-11 3.84857e-11 3.107260500000001e-10 ] [ 2.0299504e-10 -6.284880000000001e-11 -1.460593e-11 ] [ 3.5178357e-10 8.893142e-11 1.2589042e-10 ] [ 2.6540085e-10 3.277799000000001e-11 3.3522117e-10 ] [ 2.0156279e-10 2.8937209e-10 7.928935e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.72e-05 1.42e-05 -3.78e-05 ] [ 7e-07 2.63e-05 -2.8e-06 ] [ -2.33e-05 1.6e-06 9.2e-06 ] [ 9.8e-06 -5.9e-06 2.44e-05 ] [ 2.82e-05 -2.21e-05 -1.2e-06 ] [ -5.26e-05 -1.41e-05 8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.960097029376001e-14 2.275090801536e-14 -6.056227626623999e-14 ] [ 1.12152363456e-15 4.213724512704e-14 -4.48609453824e-15 ] [ -3.733071526464e-14 2.56348259328e-15 1.474002491136e-14 ] [ 1.570133088384e-14 -9.45284206272e-15 3.909310954752e-14 ] [ 4.518138070656001e-14 -3.540810331968e-14 -1.92261194496e-15 ] [ -8.427449025408001e-14 -2.259069035328e-14 1.329806595264e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.314433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.453642651340801e-18 } }