{ "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" [ [ 0.0780347 0.0112197 1.661349 ] [ 1.004167 1.583481 0.6099477 ] [ 1.186614 2.044688 2.371218 ] [ 2.525789 0.4216906 0.1723184 ] [ 2.89399 2.924329 1.948013 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.80347e-12 1.12197e-12 1.661349e-10 ] [ 1.004167e-10 1.583481e-10 6.099477e-11 ] [ 1.186614e-10 2.044688e-10 2.371218e-10 ] [ 2.525789e-10 4.216906e-11 1.723184e-11 ] [ 2.89399e-10 2.924329e-10 1.948013e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.7321855 -24.0452891 9.4753629 ] [ -92.1523617 11.0348096 -216.0130706 ] [ -51.3207796 19.8393166 240.8045587 ] [ 72.857186 -52.1918958 -17.1755639 ] [ 86.3481408 45.3630587 -17.0912871 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.52057400098536e-08 -3.852480035379489e-08 1.518120503705048e-08 ] [ -1.476443606836565e-07 1.767971410175889e-08 -3.460910943539123e-07 ] [ -8.222495391378387e-08 3.178608949104832e-08 3.858114373098214e-07 ] [ 1.167300810281919e-07 -8.362063593492272e-08 -2.751828715635391e-08 ] [ 1.38344973579102e-07 7.267963269591041e-08 -2.738326083660562e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 60.056807 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.622161288804763e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.2531176 -0.0395689 2.1839396 ] [ 0.5902113 1.2381077 0.0750505 ] [ 0.8567467 2.299213 2.4829088 ] [ 3.11992 1.2363539 -0.1409779 ] [ 3.3748342 2.2513024 2.1619251 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.531176e-11 -3.95689e-12 2.1839396e-10 ] [ 5.902113e-11 1.2381077e-10 7.50505e-12 ] [ 8.567467e-11 2.299213e-10 2.4829088e-10 ] [ 3.11992e-10 1.2363539e-10 -1.409779e-11 ] [ 3.3748342e-10 2.2513024e-10 2.1619251e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.4e-06 1.4e-06 4e-06 ] [ -8.4e-06 -4.3e-06 8.8e-06 ] [ -3.1e-06 -1.27e-05 -2.95e-05 ] [ -2.5e-06 3.35e-05 5.19e-05 ] [ 2.24e-05 -1.79e-05 -3.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.34582837256e-14 2.2430472876e-15 6.408706535999999e-15 ] [ -1.34582837256e-14 -6.8893595262e-15 1.40991543792e-14 ] [ -4.9667475654e-15 -2.03476432518e-14 -4.726421070299999e-14 ] [ -4.005441585e-15 5.367291723899999e-14 8.315296730459999e-14 ] [ 3.588875660159999e-14 -2.86789617486e-14 -5.63966175168e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.178089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.592015617857242e-18 } }