{ "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" [ [ 0.4274107 1.04679 0.754155 ] [ 0.054848 0.4363706 2.670546 ] [ 0.7705138 1.600976 2.469626 ] [ 2.416605 0.1528458 1.19099 ] [ 2.213379 0.2126116 2.884964 ] [ 2.109765 2.603732 2.132719 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.274107e-11 1.04679e-10 7.541550000000001e-11 ] [ 5.4848e-12 4.363706e-11 2.670546e-10 ] [ 7.705138e-11 1.600976e-10 2.469626e-10 ] [ 2.416605e-10 1.528458e-11 1.19099e-10 ] [ 2.213379e-10 2.126116e-11 2.884964e-10 ] [ 2.109765e-10 2.603732e-10 2.132719e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6942673 -2.3691349 -28.5645927 ] [ -50.9874488 -73.7694118 21.58097 ] [ 21.9010181 68.874426 8.8734338 ] [ 6.0043898 -2.3959019 -25.9609 ] [ 8.0317892 -6.4269464 28.5273064 ] [ 19.744519 16.086969 -4.4562176 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.521045381810266e-09 -3.795772579573926e-09 -4.576552298366697e-08 ] [ -8.169089909463135e-08 -1.181916278898839e-07 3.457652587305498e-08 ] [ 3.508929946063108e-08 1.103489960173621e-07 1.421680829770583e-08 ] [ 9.620093038987933e-09 -3.838658041536204e-09 -4.15939473776106e-08 ] [ 1.286834498545355e-08 -1.029710335005042e-08 4.570578374503865e-08 ] [ 3.163420699136905e-08 2.577416584368235e-08 -7.139647714739557e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 33.679688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.396080915401019e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9888397 0.9128185 0.5221167 ] [ -1.2825632 1.1794539 3.7831705 ] [ 0.3504174 2.0485687 2.4170508 ] [ 2.6281991 -0.6859618 0.3663696 ] [ 3.9624327 -1.454838 2.0682723 ] [ 1.3451958 4.0532847 2.9460201 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.888397e-11 9.128185e-11 5.221167e-11 ] [ -1.2825632e-10 1.1794539e-10 3.7831705e-10 ] [ 3.504174e-11 2.0485687e-10 2.4170508e-10 ] [ 2.6281991e-10 -6.859617999999999e-11 3.663696000000001e-11 ] [ 3.9624327e-10 -1.454838e-10 2.0682723e-10 ] [ 1.3451958e-10 4.0532847e-10 2.9460201e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.32e-05 -6e-05 5.67e-05 ] [ -3.41e-05 6.7e-06 1e-07 ] [ -3.1e-06 5.24e-05 4.06e-05 ] [ -3.8e-06 -1.84e-05 -7.9e-05 ] [ -9.5e-06 6.3e-06 -9.2e-06 ] [ -2.27e-05 1.29e-05 -9.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.172793296088e-13 -9.613059803999999e-14 9.08434151478e-14 ] [ -5.46342232194e-14 1.07345834478e-14 1.602176634e-16 ] [ -4.9667475654e-15 8.395405562159998e-14 6.504837134039999e-14 ] [ -6.088271209199999e-15 -2.94800500656e-14 -1.26571954086e-13 ] [ -1.5220678023e-14 1.00937127942e-14 -1.47400250328e-14 ] [ -3.636940959179999e-14 2.06680785786e-14 -1.47400250328e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.241847 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.1215777854403e-18 } }