{ "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" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.535864 -3.6198823 0.9959069 ] [ -4.4155018 1.8832493 -4.0505335 ] [ -2.208419 5.7615706 5.9116872 ] [ 8.6106794 -11.1297052 -13.4603798 ] [ 2.1125394 -2.4836131 20.1427174 ] [ -0.5634339 9.5883807 -9.5393982 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.665078635128372e-09 -5.799690791107731e-09 1.595618751673404e-09 ] [ -7.074413753060318e-09 3.017297999597965e-09 -6.489670075467197e-09 ] [ -3.538277290730515e-09 9.231053714408627e-09 9.471567021322615e-09 ] [ 1.379582922388417e-08 -1.783175346783619e-08 -2.156590582264858e-08 ] [ 3.38466123719886e-09 -3.979186843932612e-09 3.227219089766136e-08 ] [ -9.027206219461651e-10 1.536227938886994e-08 -1.528380077254161e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -3.7119499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.947199347360898e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.4605916 0.1197224 1.6352176 ] [ -0.1210768 2.3099444 0.8498403 ] [ 1.5476224 3.3601261 2.5428499 ] [ 2.9316659 0.5271897 0.9413724 ] [ 2.1293314 1.1698989 3.3281826 ] [ 2.3500108 2.7174363 0.1560536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.605916e-11 1.197224e-11 1.6352176e-10 ] [ -1.210768e-11 2.3099444e-10 8.498403e-11 ] [ 1.5476224e-10 3.3601261e-10 2.5428499e-10 ] [ 2.9316659e-10 5.271897e-11 9.413724000000001e-11 ] [ 2.1293314e-10 1.1698989e-10 3.3281826e-10 ] [ 2.3500108e-10 2.7174363e-10 1.560536e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.9e-06 -8.3e-06 -1.65e-05 ] [ 1.05e-05 6.8e-06 3.55e-05 ] [ 8.8e-06 -8e-07 -1.59e-05 ] [ 2.61e-05 9.3e-06 1.4e-06 ] [ -2.53e-05 5e-06 7e-07 ] [ -1.23e-05 -1.21e-05 -5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.265719530432e-14 -1.329806595264e-14 -2.64359142432e-14 ] [ 1.68228545184e-14 1.089480102144e-14 5.68772700384e-14 ] [ 1.409915426304e-14 -1.28174129664e-15 -2.547460827072e-14 ] [ 4.181680980288e-14 1.490024257344e-14 2.24304726912e-15 ] [ -4.053506850624e-14 8.010883104e-15 1.12152363456e-15 ] [ -1.970677243584e-14 -1.938633711168e-14 -8.33131842816e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.187542 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.273094809901807e-18 } }