{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7303574 -0.6603403 -2.8549587 ] [ 0.6955022 -0.9505342 3.5189061 ] [ -1.3546024 -0.655377 -1.3454289 ] [ -3.9525176 -2.9244336 4.4676686 ] [ 1.6462238 4.4600297 -1.2273736 ] [ 1.388059 0.2729378 -3.3734401 ] [ 2.3076924 0.4577176 0.8146267 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.170161551108274e-09 -1.057981790432058e-09 -4.574148082489561e-09 ] [ 1.114317364554966e-09 -1.522923672510831e-09 5.637909084210507e-09 ] [ -2.17031229575957e-09 -1.050029707210041e-09 -2.155614728528661e-09 ] [ -6.332631292020527e-09 -4.685459143001979e-09 7.157994180402267e-09 ] [ 2.637541284964535e-09 7.145755313413637e-09 -1.966469286907131e-09 ] [ 2.223915678091027e-09 4.372945620925863e-10 -5.404846859889214e-09 ] [ 3.697330811277842e-09 7.333444376486861e-10 1.305175853419455e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.935113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.635916156880616e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9199366 0.8867089 2.520713 ] [ 2.5073801 2.9805206 1.0754352 ] [ 0.9754039 2.5707739 2.6811123 ] [ 2.0772831 2.1477612 4.6046398 ] [ 2.8426193 4.2356162 3.3014973 ] [ 4.5560735 2.8107019 2.0065924 ] [ 4.2902564 2.2960503 4.1877636 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9199366e-10 8.867089e-11 2.520713e-10 ] [ 2.5073801e-10 2.9805206e-10 1.0754352e-10 ] [ 9.754039e-11 2.5707739e-10 2.6811123e-10 ] [ 2.0772831e-10 2.1477612e-10 4.6046398e-10 ] [ 2.8426193e-10 4.2356162e-10 3.3014973e-10 ] [ 4.5560735e-10 2.8107019e-10 2.0065924e-10 ] [ 4.2902564e-10 2.2960503e-10 4.1877636e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.9e-06 -1.67e-05 1.73e-05 ] [ -1.04e-05 -9.6e-06 -8e-07 ] [ -1.52e-05 1.33e-05 -1.37e-05 ] [ -1.29e-05 2.6e-06 -1.64e-05 ] [ 4.8e-06 3.7e-06 1.97e-05 ] [ 9e-07 1.26e-05 -8.2e-06 ] [ 2.38e-05 -6.1e-06 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.425937192512e-14 -2.675634956736e-14 2.771765553984e-14 ] [ -1.666263685632e-14 -1.538089555968e-14 -1.28174129664e-15 ] [ -2.435308463616e-14 2.130894905664e-14 -2.194981970496e-14 ] [ -2.066807840832e-14 4.16565921408e-15 -2.627569658112e-14 ] [ 7.69044777984e-15 5.928053496960001e-15 3.156287942976e-14 ] [ 1.44195895872e-15 2.018742542208e-14 -1.313784829056e-14 ] [ 3.813180357504e-14 -9.77327738688e-15 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -32.399964 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.191046483556165e-18 } }