{ "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" [ [ 2.537066 3.211759 2.539973 ] [ 6.041706 2.511317 2.608179 ] [ 4.688193 2.566304 0.9930699 ] [ 3.947295 1.472235 2.90393 ] [ 4.605333 4.643852 2.971434 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.537066e-10 3.211759e-10 2.539973e-10 ] [ 6.041706e-10 2.511317e-10 2.608179e-10 ] [ 4.688193e-10 2.566304e-10 9.930699e-11 ] [ 3.947295e-10 1.472235e-10 2.90393e-10 ] [ 4.605333e-10 4.643852e-10 2.971434e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0563962 1.7461542 0.1436971 ] [ 4.8846809 1.148882 3.202545 ] [ -1.5802776 1.2210925 -6.0917696 ] [ -2.0166658 -4.0049495 2.817732 ] [ -0.2313413 -0.1111792 -0.0722045 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.692533293941961e-09 2.797647435551728e-09 2.302281340967597e-10 ] [ 7.826121538048304e-09 1.840711880457946e-09 5.131042726059936e-09 ] [ -2.531883825093934e-09 1.956405855334224e-09 -9.760090832420168e-09 ] [ -3.231054796726929e-09 -6.41663645638465e-09 4.514504334080025e-09 ] [ -3.706496222854791e-10 -1.781287149592474e-10 -1.156843618165536e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.31615 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.652829434666592e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6293078 3.2546624 2.6262318 ] [ 6.0318719 2.5659874 2.9661315 ] [ 4.4972364 2.7641651 0.8318267 ] [ 3.9758542 1.2054519 2.8929541 ] [ 4.6853227 4.6152002 2.6994418 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6293078e-10 3.2546624e-10 2.6262318e-10 ] [ 6.0318719e-10 2.5659874e-10 2.9661315e-10 ] [ 4.497236400000001e-10 2.7641651e-10 8.318267000000001e-11 ] [ 3.9758542e-10 1.2054519e-10 2.8929541e-10 ] [ 4.6853227e-10 4.615200200000001e-10 2.6994418e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.34e-05 2.01e-05 4.1e-06 ] [ -1.47e-05 -1.33e-05 3.3e-06 ] [ 2.2e-06 5.1e-06 -3.7e-06 ] [ 1.89e-05 -4.8e-06 2.9e-06 ] [ -1.99e-05 -7.1e-06 -6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.146916671872e-14 3.220375007808e-14 6.568924145279999e-15 ] [ -2.355199632576e-14 -2.130894905664e-14 5.28718284864e-15 ] [ 3.52478856576e-15 8.17110076608e-15 -5.928053496960001e-15 ] [ 3.028113813312e-14 -7.69044777984e-15 4.646312200320001e-15 ] [ -3.188331475392e-14 -1.137545400768e-14 -1.057436569728e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }