{ "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" [ [ 0.5231689 0.1640524 1.493785 ] [ 2.625554 0.0718253 0.0473088 ] [ 2.391634 1.372958 2.83206 ] [ 1.806242 1.946446 0.9821647 ] [ 1.54049 2.8226 2.60214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.231689000000001e-11 1.640524e-11 1.493785e-10 ] [ 2.625554e-10 7.18253e-12 4.73088e-12 ] [ 2.391634e-10 1.372958e-10 2.83206e-10 ] [ 1.806242e-10 1.946446e-10 9.821647e-11 ] [ 1.54049e-10 2.8226e-10 2.60214e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.11041 -4.9826848 0.3022581 ] [ 3.566396 -4.0667427 -4.7575278 ] [ 5.8669937 -4.6591998 7.2064359 ] [ 0.1794083 4.069847 -7.317849 ] [ -3.502388 9.6387804 4.5666827 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.789956045502528e-09 -7.983141095375524e-09 4.842708612674284e-10 ] [ 5.713996291714637e-09 -6.515640076749068e-09 -7.622399813966058e-09 ] [ 9.399960140520889e-09 -7.464860991196035e-09 1.154598311827381e-08 ] [ 2.874437838374726e-10 6.520613713633018e-09 -1.172448658234466e-08 ] [ -5.61144417057047e-09 1.544302860990527e-08 7.316632256551821e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 35.463824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.681930969696595e-18 } "relaxed-configuration-positions" { "source-value" [ [ -1.9194727 -1.3113057 1.8058715 ] [ 4.5111145 -2.4494976 -1.7732881 ] [ 4.5570351 0.0142694 5.1559894 ] [ 1.739839 4.3495016 -2.1140815 ] [ -0.001427 5.7749139 4.8829672 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.9194727e-10 -1.3113057e-10 1.8058715e-10 ] [ 4.5111145e-10 -2.4494976e-10 -1.7732881e-10 ] [ 4.557035100000001e-10 1.42694e-12 5.1559894e-10 ] [ 1.739839e-10 4.3495016e-10 -2.1140815e-10 ] [ -1.427e-13 5.7749139e-10 4.8829672e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ -0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.846037335159101e-34 } }