{ "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" [ [ 0.1226517 0.1643142 2.08525 ] [ 0.897513 2.739377 0.422181 ] [ 0.4967103 2.508008 2.34433 ] [ 2.384655 1.344784 0.6822557 ] [ 2.452846 2.947826 1.504929 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.226517e-11 1.643142e-11 2.08525e-10 ] [ 8.97513e-11 2.739377e-10 4.22181e-11 ] [ 4.967103e-11 2.508008e-10 2.34433e-10 ] [ 2.384655e-10 1.344784e-10 6.822557000000001e-11 ] [ 2.452846e-10 2.947826e-10 1.504929e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4668269 0.388174 0.2147393 ] [ -12.1726065 5.1789116 -13.7237485 ] [ -12.0168576 0.5920609 13.2736379 ] [ 9.6096622 -18.1269104 -8.4853197 ] [ 14.112975 11.9677638 8.7206909 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.479391451405396e-10 6.219233076024192e-10 3.440502860269574e-10 ] [ -1.950266554849812e-08 8.297531086709923e-09 -2.198786899643907e-08 ] [ -1.92531283022028e-08 9.485861320698067e-10 2.126671231634481e-08 ] [ 1.53963761106255e-08 -2.904251205021638e-08 -1.359498084335367e-08 ] [ 2.261147859493488e-08 1.917447136361657e-08 1.397208707720331e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.5772112 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.333500773103914e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6631907 0.3683098 2.1131825 ] [ 0.4237676 2.6849737 -0.0304311 ] [ 0.3237928 2.7432977 2.3807688 ] [ 2.2179566 1.1384242 0.4348054 ] [ 2.7256682 2.7693037 2.1406201 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.631907e-11 3.683098e-11 2.1131825e-10 ] [ 4.237676e-11 2.6849737e-10 -3.04311e-12 ] [ 3.237928e-11 2.7432977e-10 2.3807688e-10 ] [ 2.2179566e-10 1.1384242e-10 4.348054e-11 ] [ 2.7256682e-10 2.7693037e-10 2.1406201e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.7e-05 -9.6e-06 2.39e-05 ] [ -2e-07 -3.1e-06 -7.48e-05 ] [ 1.6e-06 -7.9e-06 5.58e-05 ] [ 8e-07 1.26e-05 -2.21e-05 ] [ 1.48e-05 8e-06 1.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.72370025536e-14 -1.538089555968e-14 3.829202123712e-14 ] [ -3.2043532416e-16 -4.96674752448e-15 -1.1984281123584e-13 ] [ 2.56348259328e-15 -1.265719530432e-14 8.940145544064e-14 ] [ 1.28174129664e-15 2.018742542208e-14 -3.540810331968e-14 ] [ 2.371221398784e-14 1.28174129664e-14 2.739722021568e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.3509582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.337970998931805e-18 } }