{ "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" [ [ 0.9136055 0.1992462 0.0711002 ] [ 0.7203108 0.3740979 2.589381 ] [ 1.027468 2.872573 2.429267 ] [ 2.566191 2.896163 0.5924317 ] [ 2.633567 2.125326 2.686178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.136055e-11 1.992462e-11 7.11002e-12 ] [ 7.203108000000001e-11 3.740979e-11 2.589381e-10 ] [ 1.027468e-10 2.872573e-10 2.429267e-10 ] [ 2.566191e-10 2.896163e-10 5.924317e-11 ] [ 2.633567e-10 2.125326e-10 2.686178e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7656337 1.5170727 1.7153755 ] [ 0.7384879 1.1212511 -1.5573714 ] [ -13.3492663 5.4542069 -1.9429116 ] [ -0.8999066 -1.1536821 -1.3401697 ] [ 12.7450513 -6.9388486 3.1250772 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.226680414236601e-09 2.430618411993932e-09 2.74833452199311e-09 ] [ 1.183188048123688e-09 1.796442298466283e-09 -2.495184046982566e-09 ] [ -2.138788237069332e-08 8.738602780186044e-09 -3.112887541801121e-09 ] [ -1.441809315423617e-09 -1.848402488455447e-09 -2.14718856124455e-09 ] [ 2.041982322375665e-08 -1.111726100219081e-08 5.006925628035126e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.604394 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.37857589029518e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7953142 0.926709 0.3310435 ] [ 1.0225052 0.3800695 2.657018 ] [ 0.6732735 2.6508141 1.9864463 ] [ 2.5714458 2.5282033 0.5339292 ] [ 2.7986036 1.9816101 2.8599209 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.953142e-11 9.26709e-11 3.310435e-11 ] [ 1.0225052e-10 3.800695e-11 2.657018e-10 ] [ 6.732735e-11 2.6508141e-10 1.9864463e-10 ] [ 2.5714458e-10 2.5282033e-10 5.339292e-11 ] [ 2.7986036e-10 1.9816101e-10 2.8599209e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-06 -3.27e-05 -3.13e-05 ] [ 1.11e-05 5.8e-05 3.2e-06 ] [ 1.44e-05 -8.4e-06 1.32e-05 ] [ -2.01e-05 1.22e-05 2.38e-05 ] [ -8.7e-06 -2.92e-05 -8.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.28718284864e-15 -5.239117550016001e-14 -5.014812823104e-14 ] [ 1.778416049088e-14 9.29262440064e-14 5.126965186560001e-15 ] [ 2.307134333952e-14 -1.345828361472e-14 2.114873139456e-14 ] [ -3.220375007808e-14 1.954655477376e-14 3.813180357504e-14 ] [ -1.393893660096e-14 -4.678355732736e-14 -1.425937192512e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.137319633913408e-18 } }