{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0299584 0.6173503 0.5342358 ] [ 0.7975385 2.616511 1.362514 ] [ 1.80202 0.5667157 2.620782 ] [ 2.455492 1.646275 1.01187 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.99584e-12 6.173503e-11 5.342358000000001e-11 ] [ 7.975385000000001e-11 2.616511e-10 1.362514e-10 ] [ 1.80202e-10 5.667157e-11 2.620782e-10 ] [ 2.455492e-10 1.646275e-10 1.01187e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2700642 -2.1270276 -1.1606319 ] [ -6.3414091 6.9565742 0.6731786 ] [ -0.4422672 -4.6444454 5.4324266 ] [ 9.0537405 -0.1851012 -4.9449733 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.637043788955056e-09 -3.407873892516334e-09 -1.859537295534684e-09 ] [ -1.016005740294837e-08 1.114566054410046e-08 1.078551014542875e-09 ] [ -7.085901679866778e-10 -7.441221836462105e-09 8.703706892732034e-09 ] [ 1.45056913598901e-08 -2.96564815122025e-10 -7.922720611740225e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.491179 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.797838614427924e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.2426027 0.696196 1.2970061 ] [ 0.7047828 2.7422967 0.6646767 ] [ 1.8377284 -0.0188821 2.0999975 ] [ 2.7851003 2.0272414 1.4677215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.426027e-11 6.96196e-11 1.2970061e-10 ] [ 7.047828e-11 2.7422967e-10 6.646767e-11 ] [ 1.8377284e-10 -1.88821e-12 2.0999975e-10 ] [ 2.7851003e-10 2.0272414e-10 1.4677215e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.12e-05 -3.9e-06 -1.12e-05 ] [ -3.2e-06 6e-07 1.45e-05 ] [ -8.1e-06 1.19e-05 8.6e-06 ] [ 1e-07 -8.5e-06 -1.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.794437815296e-14 -6.24848882112e-15 -1.794437815296e-14 ] [ -5.126965186560001e-15 9.6130597248e-16 2.32315610016e-14 ] [ -1.297763062848e-14 1.906590178752e-14 1.377871893888e-14 ] [ 1.6021766208e-16 -1.36185012768e-14 -1.906590178752e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.9297943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.43071076560131e-18 } }