{ "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" [ [ 3.095423 1.998262 0.8352723 ] [ 3.003915 2.107064 3.861401 ] [ 2.921301 4.877628 0.9226955 ] [ 1.839297 3.508607 2.236053 ] [ 4.200263 0.9739816 2.537715 ] [ 4.333089 3.298954 2.357847 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.095423e-10 1.998262e-10 8.352723e-11 ] [ 3.003915e-10 2.107064e-10 3.861401e-10 ] [ 2.921301e-10 4.877627999999999e-10 9.226955000000001e-11 ] [ 1.839297e-10 3.508607e-10 2.236053e-10 ] [ 4.200263e-10 9.739816e-11 2.537715e-10 ] [ 4.333089e-10 3.298954000000001e-10 2.357847e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8394604 -3.428605 -4.9880782 ] [ -4.5607285 1.3974146 6.4762329 ] [ 2.0094579 5.0899328 -2.6301173 ] [ -5.0007179 -1.3021552 2.8085566 ] [ 4.5244635 -7.4203094 -1.56336 ] [ 4.8669854 5.6637222 -0.103234 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.947140447767416e-09 -5.493230772957984e-09 -7.991782274762149e-09 ] [ -7.307092576516252e-09 2.238905001684584e-09 1.037606894323579e-08 ] [ 3.219506467861865e-09 8.154971333603082e-09 -4.21391244802162e-09 ] [ -8.012033306596072e-09 -2.086282618093148e-09 4.499803722713538e-09 ] [ 7.248989641362942e-09 -1.188864623978248e-08 -2.504778841893888e-09 ] [ 7.797770221654936e-09 9.074283295545942e-09 -1.653991012716672e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.3806439 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.502944834463014e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9718855 1.6942201 0.7339933 ] [ 2.948825 2.5010967 3.870638 ] [ 3.0130461 5.1613982 1.5145763 ] [ 1.5694499 3.2899962 1.9853705 ] [ 4.3211189 0.7757096 2.6523801 ] [ 4.5689627 3.3420757 1.9940256 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9718855e-10 1.6942201e-10 7.339933e-11 ] [ 2.948825e-10 2.5010967e-10 3.870638e-10 ] [ 3.0130461e-10 5.1613982e-10 1.5145763e-10 ] [ 1.5694499e-10 3.2899962e-10 1.9853705e-10 ] [ 4.3211189e-10 7.757096000000001e-11 2.6523801e-10 ] [ 4.5689627e-10 3.3420757e-10 1.9940256e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.85e-05 2.15e-05 -8.12e-05 ] [ 6.95e-05 5.87e-05 5.96e-05 ] [ -8.38e-05 -0.0001262 3.41e-05 ] [ -0.0003014 9.32e-05 -2.76e-05 ] [ -3.98e-05 -2.75e-05 8.8e-06 ] [ 0.0002871 -1.97e-05 6.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.097490985248e-13 3.44467973472e-14 -1.3009674160896e-13 ] [ 1.113512751456e-13 9.404776764096e-14 9.548972659968001e-14 ] [ -1.3426240082304e-13 -2.0219468954496e-13 5.463422276928e-14 ] [ -4.8289603350912e-13 1.4932286105856e-13 -4.422007473408001e-14 ] [ -6.376662950784e-14 -4.4059857072e-14 1.409915426304e-14 ] [ 4.5998490783168e-13 -3.156287942976e-14 1.009371271104e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.876968 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.223335369718974e-18 } }