{ "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" [ [ 0.2482594 0.208506 0.7144033 ] [ 0.1842271 0.5542422 2.415306 ] [ 0.3347056 2.949491 0.3757933 ] [ 2.042519 0.2544893 1.784175 ] [ 2.203059 1.053322 2.694572 ] [ 1.978392 2.822156 1.26577 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.482594e-11 2.08506e-11 7.144033e-11 ] [ 1.842271e-11 5.542422e-11 2.415306e-10 ] [ 3.347056e-11 2.949491e-10 3.757933e-11 ] [ 2.042519e-10 2.544893e-11 1.784175e-10 ] [ 2.203059e-10 1.053322e-10 2.694572e-10 ] [ 1.978392e-10 2.822156e-10 1.26577e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.6485455 -16.0717813 -107.2941657 ] [ -21.4029859 15.694959 96.3251759 ] [ -52.2965606 0.9424466 -27.9658376 ] [ -46.6270359 -363.8199414 -395.0789254 ] [ 82.1477405 366.9009517 402.0472382 ] [ 53.8273873 -3.6466346 31.9665147 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.507173374962505e-08 -2.574983225347063e-08 -1.719042038327812e-07 ] [ -3.429136362429205e-08 2.514609637421455e-08 1.543299448214276e-07 ] [ -8.378832674157042e-08 1.509965908872449e-09 -4.480621118380958e-08 ] [ -7.470474681618228e-08 -5.829038042919061e-07 -6.329862176466673e-07 ] [ 1.316151892806453e-07 5.878401269630101e-07 6.441506855012486e-07 ] [ 8.624098149080683e-08 -5.84255270072036e-09 5.121600250079953e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 190.99369 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.060056248383228e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.029682 0.3048386 0.6453342 ] [ -0.212129 0.7130339 3.1150081 ] [ 0.4261645 2.6426392 -0.0923109 ] [ 2.4161754 -0.3930661 1.0221285 ] [ 2.2414416 1.2335381 2.9321005 ] [ 2.0898275 3.3412228 1.6277592 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9682e-12 3.048386e-11 6.453342e-11 ] [ -2.12129e-11 7.130339000000001e-11 3.1150081e-10 ] [ 4.261645e-11 2.6426392e-10 -9.23109e-12 ] [ 2.4161754e-10 -3.930661e-11 1.0221285e-10 ] [ 2.2414416e-10 1.2335381e-10 2.9321005e-10 ] [ 2.0898275e-10 3.3412228e-10 1.6277592e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.11e-05 4.61e-05 1.25e-05 ] [ 3.78e-05 -3.4e-06 -9.4e-06 ] [ -3.07e-05 2.25e-05 -4.68e-05 ] [ -2.95e-05 -1.45e-05 -6.9e-06 ] [ 1.8e-06 1.72e-05 4.89e-05 ] [ -3.05e-05 -6.79e-05 1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.187122532288001e-14 7.386034221888001e-14 2.002720776e-14 ] [ 6.056227626623999e-14 -5.44740051072e-15 -1.506046023552e-14 ] [ -4.918682225856e-14 3.604897396800001e-14 -7.498186585344001e-14 ] [ -4.72642103136e-14 -2.32315610016e-14 -1.105501868352e-14 ] [ 2.88391791744e-15 2.755743787776e-14 7.834643675712001e-14 ] [ -4.88663869344e-14 -1.0878779255232e-13 2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.334204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.097680963057785e-18 } }