{ "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" [ [ -7.1231014 -11.6342293 -1.6673381 ] [ -16.610842 3.0671212 -26.8880918 ] [ -6.2366327 8.844611 34.4110704 ] [ 13.2643134 -9.3675158 -3.5831956 ] [ 16.7062627 9.0900129 -2.2724449 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.141246653066775e-08 -1.864009018548635e-08 -2.671370122789093e-09 ] [ -2.661350270420272e-08 4.91406987980004e-09 -4.307947205988419e-08 ] [ -9.99218710445678e-09 1.417062896427051e-08 5.513261249158291e-08 ] [ 2.125177282044416e-08 -1.500841480973461e-08 -5.740912218073428e-09 ] [ 2.676638351888309e-08 1.456380615115041e-08 -3.640858090836194e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.6531479 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.648634916104617e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.2737261 -0.6941754 1.5878132 ] [ 0.5283445 1.3491803 0.6234271 ] [ 1.012042 2.8682425 2.5271347 ] [ 2.9060284 0.9469351 0.0314511 ] [ 3.5159059 2.5152257 1.9930199 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.737261e-11 -6.941754e-11 1.5878132e-10 ] [ 5.283445e-11 1.3491803e-10 6.234271e-11 ] [ 1.012042e-10 2.8682425e-10 2.5271347e-10 ] [ 2.9060284e-10 9.469351000000001e-11 3.145110000000001e-12 ] [ 3.5159059e-10 2.5152257e-10 1.9930199e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.2e-06 7.2e-06 -2.7e-06 ] [ -6.5e-06 -6.3e-06 -3.5e-06 ] [ -3e-06 -1.3e-06 5.1e-06 ] [ -2e-07 -3e-06 2.3e-06 ] [ 6.5e-06 3.4e-06 -1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.126965186560001e-15 1.153567166976e-14 -4.32587687616e-15 ] [ -1.04141480352e-14 -1.009371271104e-14 -5.6076181728e-15 ] [ -4.8065298624e-15 -2.08282960704e-15 8.17110076608e-15 ] [ -3.2043532416e-16 -4.8065298624e-15 3.68500622784e-15 ] [ 1.04141480352e-14 5.44740051072e-15 -2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196935810426e-18 } }