{ "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" [ [ -8.7768396 -12.3274003 3.0902467 ] [ -10.7577784 2.6871576 -38.6673081 ] [ -7.5137546 10.3817905 44.1016623 ] [ 12.4649234 -9.4978395 -6.8511662 ] [ 14.5834492 8.7562917 -1.6734347 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.406204721163162e-08 -1.975067255590291e-08 4.951121015244351e-09 ] [ -1.723586104422723e-08 4.305301083125039e-09 -6.195185702709046e-08 ] [ -1.203836195454846e-08 1.663346202114354e-08 7.065865227547676e-08 ] [ 1.997100885154285e-08 -1.521721639501076e-08 -1.097677831085518e-08 ] [ 2.336526135886447e-08 1.402912584664509e-08 -2.681137952775462e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 7.0642694 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.131820727571284e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1883509 -0.155899 1.9672222 ] [ 1.0503951 1.8722472 0.3457647 ] [ 0.6306488 2.2758517 2.7401403 ] [ 2.7692796 0.2034933 -0.2626323 ] [ 3.0499204 2.789715 1.9723512 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.883509e-11 -1.55899e-11 1.9672222e-10 ] [ 1.0503951e-10 1.8722472e-10 3.457647e-11 ] [ 6.306488e-11 2.2758517e-10 2.7401403e-10 ] [ 2.7692796e-10 2.034933e-11 -2.626323e-11 ] [ 3.0499204e-10 2.789715e-10 1.9723512e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.6e-06 -3e-06 -9.8e-06 ] [ -2e-06 3.6e-06 4e-07 ] [ -5.9e-06 -2.7e-06 1.32e-05 ] [ 2.3e-06 -5.7e-06 6.5e-06 ] [ 9.3e-06 7.9e-06 -1.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.76783583488e-15 -4.8065298624e-15 -1.570133088384e-14 ] [ -3.2043532416e-15 5.76783583488e-15 6.408706483200001e-16 ] [ -9.45284206272e-15 -4.32587687616e-15 2.114873139456e-14 ] [ 3.68500622784e-15 -9.13240673856e-15 1.04141480352e-14 ] [ 1.490024257344e-14 1.265719530432e-14 -1.634220153216e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.430384 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.831349401156639e-18 } }