{ "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" [ [ 1.054063 0.143936 1.020128 ] [ 0.3465957 1.342343 2.730037 ] [ 0.4577023 2.369538 0.7306134 ] [ 2.27069 2.392327 1.674561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.054063e-10 1.43936e-11 1.020128e-10 ] [ 3.465957e-11 1.342343e-10 2.730037e-10 ] [ 4.577023e-11 2.369538e-10 7.306134e-11 ] [ 2.27069e-10 2.392327e-10 1.674561e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8508755 -13.0616165 -7.5474462 ] [ -8.4170903 -1.5614362 12.6026094 ] [ 1.1837418 3.2670604 -3.4617052 ] [ 9.0842239 11.3559924 -1.593458 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.965429478543066e-09 -2.092701675856886e-08 -1.209234194801209e-08 ] [ -1.348566540492805e-08 -2.501696595121751e-09 2.019160630810876e-08 ] [ 1.896563452649101e-09 5.234407834746693e-09 -5.546263185236297e-09 ] [ 1.455453127060435e-08 1.819430567916158e-08 -2.553001174860372e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.81966984 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.313255865242518e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0935736 -0.2826356 0.3282713 ] [ -0.2915658 1.6204495 3.3040833 ] [ 0.5542465 1.9920858 1.0413099 ] [ 2.7727966 2.9182443 1.481675 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0935736e-10 -2.826356e-11 3.282713e-11 ] [ -2.915658e-11 1.6204495e-10 3.3040833e-10 ] [ 5.542465e-11 1.9920858e-10 1.0413099e-10 ] [ 2.7727966e-10 2.9182443e-10 1.481675e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-06 -2.4e-06 -9e-07 ] [ -5.1e-06 -2.4e-06 -1.4e-06 ] [ 6.2e-06 -2.5e-06 5.4e-06 ] [ 3.9e-06 7.3e-06 -3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883169999999e-15 -3.845223921599999e-15 -1.4419589706e-15 ] [ -8.1711008334e-15 -3.845223921599999e-15 -2.2430472876e-15 ] [ 9.9334951308e-15 -4.005441585e-15 8.6517538236e-15 ] [ 6.248488872599999e-15 1.16958894282e-14 -5.1269652288e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.1471636 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.465537178729532e-18 } }