{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.167127 3.726278 2.425808 ] [ 5.703742 2.419847 2.282123 ] [ 3.651151 2.438119 0.811047 ] [ 3.941822 0.8653656 2.619853 ] [ 4.06698 3.157982 3.365965 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.167127e-10 3.726278000000001e-10 2.425808e-10 ] [ 5.703742000000001e-10 2.419847e-10 2.282123e-10 ] [ 3.651151e-10 2.438119e-10 8.11047e-11 ] [ 3.941822e-10 8.653656e-11 2.619853e-10 ] [ 4.06698e-10 3.157982e-10 3.365965e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2195103 -0.2628392 -1.8236899 ] [ 1.066228 -0.9734827 -2.1823072 ] [ -0.0162374 0.6670347 2.3920044 ] [ 0.2172707 0.2142941 -0.2554196 ] [ -1.047751 0.3549932 1.8694123 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.516942706847942e-10 -4.211148212697754e-10 -2.92187332136909e-09 ] [ 1.708285574042342e-09 -1.55969122269326e-09 -3.49644157524351e-09 ] [ -2.601518266257792e-11 1.068707401602342e-09 3.832413526530732e-09 ] [ 3.481060359248506e-10 3.433369969953773e-10 -4.092273116140877e-10 ] [ -1.678682156619821e-09 5.687618055829786e-10 2.995128681695956e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.243326 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.083120702363278e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3064101 3.9297922 2.1922261 ] [ 5.6589481 2.5090966 2.0676009 ] [ 3.5528108 2.3896865 1.0192697 ] [ 4.1177263 0.8046932 2.6678347 ] [ 3.8949267 2.9743232 3.5578645 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3064101e-10 3.9297922e-10 2.1922261e-10 ] [ 5.6589481e-10 2.5090966e-10 2.0676009e-10 ] [ 3.5528108e-10 2.3896865e-10 1.0192697e-10 ] [ 4.1177263e-10 8.046932e-11 2.6678347e-10 ] [ 3.8949267e-10 2.9743232e-10 3.5578645e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.1e-06 2.93e-05 3.6e-06 ] [ 1e-06 7.9e-06 1.81e-05 ] [ -1.1e-05 -2.24e-05 1.6e-06 ] [ 1.26e-05 -1.07e-05 -9.5e-06 ] [ 3.5e-06 -4.1e-06 -1.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.77327738688e-15 4.694377498944e-14 5.76783583488e-15 ] [ 1.6021766208e-15 1.265719530432e-14 2.899939683648e-14 ] [ -1.76239428288e-14 -3.588875630592e-14 2.56348259328e-15 ] [ 2.018742542208e-14 -1.714328984256e-14 -1.52206778976e-14 ] [ 5.6076181728e-15 -6.568924145279999e-15 -2.211003736704e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.206918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.23750515980227e-18 } }