{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.38521 1.90546 0.8111876 ] [ 1.820048 1.934055 3.373724 ] [ 3.762919 1.896883 2.504871 ] [ 3.3319 2.668439 4.803022 ] [ 3.103403 4.016922 2.717172 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.38521e-10 1.90546e-10 8.111876000000001e-11 ] [ 1.820048e-10 1.934055e-10 3.373724e-10 ] [ 3.762919e-10 1.896883e-10 2.504871e-10 ] [ 3.3319e-10 2.668439e-10 4.803022000000001e-10 ] [ 3.103403e-10 4.016922e-10 2.717172e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4760333 1.5067884 3.1960582 ] [ -3.8793314 2.9176229 -1.9985288 ] [ 6.5016319 1.517394 2.511729 ] [ 0.7412295 1.0470002 -6.5377512 ] [ -1.8874966 -6.9888055 2.8284927 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.364866044782273e-09 2.414141146972639e-09 5.120649726756131e-09 ] [ -6.215374073415333e-09 4.674547198690697e-09 -3.201996119355479e-09 ] [ 1.041676262722748e-08 2.431133191342195e-09 4.024233481585363e-09 ] [ 1.187580575547274e-09 1.677479242412924e-09 -1.047463212524715e-08 ] [ -3.024102924359489e-09 -1.119730077941846e-08 4.531744876043468e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.576817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.617204836947999e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3891231 2.2198213 1.1248454 ] [ 1.7872052 1.9416363 3.2386379 ] [ 3.9247458 1.7615954 2.6544538 ] [ 3.3722687 2.7488824 4.5591452 ] [ 2.9301371 3.7498236 2.6328944 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3891231e-10 2.2198213e-10 1.1248454e-10 ] [ 1.7872052e-10 1.9416363e-10 3.2386379e-10 ] [ 3.9247458e-10 1.7615954e-10 2.6544538e-10 ] [ 3.3722687e-10 2.7488824e-10 4.5591452e-10 ] [ 2.9301371e-10 3.7498236e-10 2.6328944e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.08e-05 2.05e-05 -6.54e-05 ] [ 2.6e-06 -3.21e-05 1.97e-05 ] [ -1.52e-05 1.21e-05 6.19e-05 ] [ 3.86e-05 -4.29e-05 7.39e-05 ] [ -5.2e-06 4.24e-05 -9.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.332527371264e-14 3.28446207264e-14 -1.0478235100032e-13 ] [ 4.16565921408e-15 -5.142986952768e-14 3.156287942976e-14 ] [ -2.435308463616e-14 1.938633711168e-14 9.917473282752e-14 ] [ 6.184401756288e-14 -6.873337703232e-14 1.1840085227712e-13 ] [ -8.33131842816e-15 6.793228872192001e-14 -1.4451633119616e-13 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }