{ "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" [ [ 0.284773 1.136187 2.117179 ] [ 0.232979 2.36751 0.607179 ] [ 0.4870779 2.766051 2.845032 ] [ 1.778488 1.070505 1.035652 ] [ 2.177899 0.7799475 2.527686 ] [ 2.528264 2.860392 0.629956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.84773e-11 1.136187e-10 2.117179e-10 ] [ 2.32979e-11 2.36751e-10 6.07179e-11 ] [ 4.870779e-11 2.766051e-10 2.845032e-10 ] [ 1.778488e-10 1.070505e-10 1.035652e-10 ] [ 2.177899e-10 7.799475000000001e-11 2.527686e-10 ] [ 2.528264e-10 2.860392e-10 6.29956e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.7318395 -10.7985401 6.1807735 ] [ -5.1985488 7.5757401 -8.325901 ] [ -0.0049128 8.907621 5.7042443 ] [ 5.1483103 -6.6477726 -18.4239177 ] [ 11.223971 -5.016285 16.6326063 ] [ 3.5630198 5.9792365 -1.7678054 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.360300882827796e-08 -1.730116848699129e-08 9.902690800160189e-09 ] [ -8.328993349447895e-09 1.213767367347705e-08 -1.333956392929534e-08 ] [ -7.87117330266624e-12 1.427158211314712e-08 9.139206856791661e-09 ] [ 8.248502399283835e-09 -1.065090584011483e-08 -2.951837020248331e-08 ] [ 1.79827839287372e-08 -8.036974550269727e-09 2.664837295683079e-08 ] [ 5.708587023007492e-09 9.57979293053402e-09 -2.832336482003992e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8419623 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.359855416654995e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.0042014 0.7449646 2.1721409 ] [ 0.141066 2.5290142 0.4743531 ] [ 0.7495405 3.0036453 2.8176027 ] [ 1.746944 0.6565472 0.4366266 ] [ 2.3554315 1.1311991 2.7798819 ] [ 2.5007003 2.9152222 1.0820787 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.2014e-13 7.449646e-11 2.1721409e-10 ] [ 1.41066e-11 2.5290142e-10 4.743531000000001e-11 ] [ 7.495405000000001e-11 3.0036453e-10 2.8176027e-10 ] [ 1.746944e-10 6.565472e-11 4.366266e-11 ] [ 2.3554315e-10 1.1311991e-10 2.7798819e-10 ] [ 2.5007003e-10 2.9152222e-10 1.0820787e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.96e-05 4.8e-06 1.18e-05 ] [ -3.41e-05 -2.25e-05 -3.52e-05 ] [ 8.5e-06 3.17e-05 3.4e-05 ] [ 1.95e-05 -2.05e-05 -3.6e-05 ] [ 1.69e-05 -2.03e-05 1.09e-05 ] [ 1.87e-05 2.67e-05 1.44e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.742442797568e-14 7.69044777984e-15 1.890568412544e-14 ] [ -5.463422276928e-14 -3.604897396800001e-14 -5.639661705216e-14 ] [ 1.36185012768e-14 5.078899887936e-14 5.44740051072e-14 ] [ 3.12424441056e-14 -3.28446207264e-14 -5.76783583488e-14 ] [ 2.707678489152e-14 -3.252418540224e-14 1.746372516672e-14 ] [ 2.996070280896e-14 4.277811577536e-14 2.307134333952e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.568499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.295436822274818e-18 } }