{ "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" [ [ 2.912622 1.78272 1.2568 ] [ 2.727936 0.232034 3.207427 ] [ 3.003232 2.746828 4.7469 ] [ 4.479923 1.355966 2.983258 ] [ 4.230826 3.711883 2.275883 ] [ 5.441026 3.401037 4.285306 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.912622e-10 1.78272e-10 1.2568e-10 ] [ 2.727936e-10 2.32034e-11 3.207427e-10 ] [ 3.003232e-10 2.746828e-10 4.7469e-10 ] [ 4.479923e-10 1.355966e-10 2.983258e-10 ] [ 4.230826000000001e-10 3.711883e-10 2.275883e-10 ] [ 5.441026e-10 3.401037e-10 4.285306000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.067452 -0.011287 7.645005 ] [ -8.4494506 -1.4946562 -0.8655162 ] [ 5.7819176 -1.7345594 -5.857832 ] [ 5.9939417 14.4423729 -1.1034032 ] [ -0.6994444 -7.8534983 4.3795015 ] [ -6.6944162 -3.3483719 -4.1977552 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.516776500626203e-09 -1.80837675189696e-11 1.22486482768991e-08 ] [ -1.353751220992453e-08 -2.394703219773769e-09 -1.386709820563657e-09 ] [ 9.263653202112047e-09 -2.779070518068876e-09 -9.385281478974106e-09 ] [ 9.603353258178208e-09 2.31392322092555e-08 -1.767846810355907e-09 ] [ -1.120633465229483e-09 -1.258269136775255e-08 7.016734914058531e-09 ] [ -1.072563712554478e-08 -5.364683175923676e-09 -6.725545241281627e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.895864 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.828539463461637e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8488368 1.9585232 1.8032506 ] [ 2.8430345 0.4430368 3.4242046 ] [ 3.0307217 2.5869411 3.9203634 ] [ 4.7114634 1.5045481 2.914412 ] [ 4.2340955 3.595274 2.3566126 ] [ 5.127413 3.1421447 4.3367308 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8488368e-10 1.9585232e-10 1.8032506e-10 ] [ 2.8430345e-10 4.430368e-11 3.4242046e-10 ] [ 3.0307217e-10 2.5869411e-10 3.9203634e-10 ] [ 4.711463400000001e-10 1.5045481e-10 2.914412e-10 ] [ 4.234095499999999e-10 3.595274e-10 2.3566126e-10 ] [ 5.127413e-10 3.1421447e-10 4.3367308e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.19e-05 -5.88e-05 2.68e-05 ] [ -4.05e-05 4.05e-05 -5.28e-05 ] [ 3.32e-05 1.86e-05 -1.61e-05 ] [ 0.0001176 -2.7e-06 4.59e-05 ] [ -3.34e-05 3.97e-05 -3.34e-05 ] [ -5e-06 -3.72e-05 2.96e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.1519649903552e-13 -9.420798530304e-14 4.293833343744e-14 ] [ -6.488815314240001e-14 6.488815314240001e-14 -8.459492557824e-14 ] [ 5.319226381056e-14 2.980048514688e-14 -2.579504359488e-14 ] [ 1.8841597060608e-13 -4.32587687616e-15 7.353990689472e-14 ] [ -5.351269913472e-14 6.360641184576e-14 -5.351269913472e-14 ] [ -8.010883104e-15 -5.960097029376001e-14 4.742442797568e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }