{ "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" [ [ 0.7955699 1.924478 0.0578634 ] [ 0.2789322 2.342777 2.34838 ] [ 2.533834 0.6960937 0.5593318 ] [ 1.694509 0.4311754 2.932881 ] [ 2.816233 2.726519 1.407602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.955699e-11 1.924478e-10 5.786340000000001e-12 ] [ 2.789322e-11 2.342777e-10 2.34838e-10 ] [ 2.533834e-10 6.960937e-11 5.593318000000001e-11 ] [ 1.694509e-10 4.311754e-11 2.932881e-10 ] [ 2.816233e-10 2.726519e-10 1.407602e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.7816001 5.33185 -7.5143548 ] [ 0.068966 2.1995211 2.3012073 ] [ 8.1095967 -16.5154004 -1.2375572 ] [ 0.8239163 -1.7424119 0.623873 ] [ 1.779121 10.7264413 5.8268317 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.727402761503494e-08 8.542565415612481e-09 -1.203932358095626e-08 ] [ 1.104957128300928e-10 3.524021283376299e-09 3.686940535674292e-09 ] [ 1.299300623685683e-08 -2.646058840403097e-08 -1.98278521274271e-09 ] [ 1.320059433356039e-09 -2.791651609983708e-09 9.995547349483583e-10 ] [ 2.850466071774317e-09 1.718565347524356e-08 9.33561352307632e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.819059 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.893622000965583e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6542971 1.9727661 -0.1159652 ] [ 0.5321737 2.3894175 2.4809101 ] [ 2.6888299 0.5414598 0.7467762 ] [ 1.4957244 0.0946915 2.9318245 ] [ 2.748053 3.1227081 1.2625127 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.542971e-11 1.9727661e-10 -1.159652e-11 ] [ 5.321737e-11 2.3894175e-10 2.4809101e-10 ] [ 2.6888299e-10 5.414598000000001e-11 7.467762e-11 ] [ 1.4957244e-10 9.46915e-12 2.9318245e-10 ] [ 2.748053e-10 3.1227081e-10 1.2625127e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.4e-06 -2.25e-05 -1e-07 ] [ -5.8e-06 5.76e-05 2.49e-05 ] [ 3.31e-05 1.32e-05 -7e-07 ] [ 1.4e-06 -3.3e-06 -3.47e-05 ] [ -2.14e-05 -4.49e-05 1.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.185610699392e-14 -3.604897396800001e-14 -1.6021766208e-16 ] [ -9.292624400640001e-15 9.228537335808e-14 3.989419785791999e-14 ] [ 5.303204614848e-14 2.114873139456e-14 -1.12152363456e-15 ] [ 2.24304726912e-15 -5.28718284864e-15 -5.559552874176001e-14 ] [ -3.428657968511999e-14 -7.193773027392e-14 1.698307218048e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.87929 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.544142719290323e-18 } }