{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -27.2358938 5.8058734 -23.2710822 ] [ -8.512738 -12.0719917 34.6130239 ] [ 12.7419699 -17.0550668 -17.8462618 ] [ -8.5563861 33.6994437 -19.2365184 ] [ 31.563048 -10.3782586 25.7408384 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.363671229295167e-08 9.302034624804608e-09 -3.728438384155503e-08 ] [ -1.363890980259575e-08 -1.934146286823165e-08 5.545617766777164e-08 ] [ 2.041488627671731e-08 -2.732522929314227e-08 -2.859286342463613e-08 ] [ -1.370884176795809e-08 5.399246083010585e-08 -3.082030004606903e-08 ] [ 5.05695775867882e-08 -1.662780329353654e-08 4.124136948427088e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 24.604242 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.942034130490544e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.1840137 1.0005411 0.8253973 ] [ 0.3758757 0.4204131 3.2520537 ] [ 1.9709342 -0.3044552 0.387343 ] [ 1.4726156 2.8975327 1.2677917 ] [ 2.7302983 1.0084526 2.4460658 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.840137e-11 1.0005411e-10 8.253973e-11 ] [ 3.758757e-11 4.204131e-11 3.2520537e-10 ] [ 1.9709342e-10 -3.044552e-11 3.87343e-11 ] [ 1.4726156e-10 2.8975327e-10 1.2677917e-10 ] [ 2.7302983e-10 1.0084526e-10 2.4460658e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.46e-05 6.2e-06 -1.73e-05 ] [ -1.25e-05 -2.4e-06 3.96e-05 ] [ 1.55e-05 -2.4e-05 -3.26e-05 ] [ 1.8e-06 1.21e-05 1.8e-06 ] [ 9.8e-06 8.1e-06 8.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.339177866368e-14 9.93349504896e-15 -2.771765553984e-14 ] [ -2.002720776e-14 -3.84522388992e-15 6.344619418368e-14 ] [ 2.48337376224e-14 -3.84522388992e-14 -5.223095783807999e-14 ] [ 2.88391791744e-15 1.938633711168e-14 2.88391791744e-15 ] [ 1.570133088384e-14 1.297763062848e-14 1.345828361472e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.4498528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.033380336376142e-18 } }