{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.5941565e-10 1.8712318e-10 3.0666598e-10 ] [ 2.2587414e-10 1.3949904e-10 5.604901800000001e-10 ] [ 2.9856894e-10 4.3896594e-10 2.8925606e-10 ] [ 1.3368717e-10 3.5229947e-10 4.5650462e-10 ] [ 4.5704882e-10 1.485497e-10 1.8242547e-10 ] [ 3.8902735e-10 3.4676441e-10 9.107914e-11 ] [ 3.9089352e-10 3.1704396e-10 4.8447051e-10 ] ] "source-value" [ [ 2.5941565 1.8712318 3.0666598 ] [ 2.2587414 1.3949904 5.6049018 ] [ 2.9856894 4.3896594 2.8925606 ] [ 1.3368717 3.5229947 4.5650462 ] [ 4.5704882 1.485497 1.8242547 ] [ 3.8902735 3.4676441 0.9107914 ] [ 3.9089352 3.1704396 4.8447051 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.608508983001165e-10 -6.918346048863514e-10 1.3651499706482e-09 ] [ 5.204238164981184e-11 -8.685495591954047e-11 -1.332754600246272e-10 ] [ 4.006130487946944e-11 1.251750152475245e-10 -3.009905076016608e-10 ] [ -2.296992555942336e-11 1.005771180237063e-10 1.863762395501395e-10 ] [ 2.148919392648e-10 -2.745826314493248e-10 -1.700473360839322e-10 ] [ 5.564087034012864e-10 8.966241796863591e-10 -8.564606559384826e-10 ] [ -2.795835053358278e-10 -6.910412070237312e-11 -9.075225054963649e-11 ] ] "source-value" [ [ -0.3500556 -0.4318092 0.8520596 ] [ 0.0324823 -0.0542106 -0.083184 ] [ 0.0250043 0.0781281 -0.1878635 ] [ -0.0143367 0.0627753 0.1163269 ] [ 0.134125 -0.171381 -0.1061352 ] [ 0.347283 0.5596288 -0.5345607 ] [ -0.1745023 -0.0431314 -0.0566431 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.757141025838279e-18 "source-value" -23.45023 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.97800135311344e-09 -7.727110227236105e-09 -7.49206675130553e-09 ] [ -3.163350177302825e-09 -1.347815461025947e-08 8.135168590787657e-09 ] [ -4.630199110044614e-10 6.688338214052115e-09 -2.672676537605693e-09 ] [ -9.460867365413587e-09 6.738558600448752e-09 -4.294825091072275e-10 ] [ 3.147674961897903e-09 -2.652814994908284e-09 -1.158551538443309e-10 ] [ 1.020722372027044e-09 3.63472559960242e-09 -5.24981368113646e-09 ] [ 1.489684147290937e-08 6.796457418300574e-09 7.824726042211587e-09 ] ] "source-value" [ [ -3.731175 -4.8228829 -4.6761803 ] [ -1.9744079 -8.4124025 5.0775729 ] [ -0.2889943 4.1745324 -1.6681535 ] [ -5.905009 4.2058775 -0.2680619 ] [ 1.9646242 -1.6557569 -0.0723111 ] [ 0.6370848 2.2686173 -3.276676 ] [ 9.2978772 4.2420151 4.8838099 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.899242256164966e-18 "source-value" -18.095647 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] "source-value" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] } "instance-id" 1 }