{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.851893 1.689536 1.360291 ] [ 1.367517 2.93292 5.4803 ] [ 1.756353 1.339195 3.328571 ] [ 1.204701 3.536746 3.011508 ] [ 3.888723 1.68848 3.240915 ] [ 3.83892 3.544284 1.733331 ] [ 3.269318 3.65155 3.991072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.851893e-10 1.689536e-10 1.360291e-10 ] [ 1.367517e-10 2.93292e-10 5.4803e-10 ] [ 1.756353e-10 1.339195e-10 3.328571e-10 ] [ 1.204701e-10 3.536746e-10 3.011508e-10 ] [ 3.888723e-10 1.68848e-10 3.240915e-10 ] [ 3.83892e-10 3.544284e-10 1.733331e-10 ] [ 3.269318e-10 3.65155e-10 3.991072e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6663797 -5.5452681 -10.400217 ] [ 0.0151253 -0.2900592 -0.9395443 ] [ -9.2182756 -7.333671 6.7950182 ] [ -3.1647322 2.6642548 -2.4027838 ] [ 9.7755608 -4.7705922 4.0243249 ] [ 5.9109706 9.6442157 -4.3429457 ] [ 1.3477309 5.6311201 7.2661477 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.47636452071193e-09 -8.884498979085576e-09 -1.666298466592957e-08 ] [ 2.42334022422402e-11 -4.647260727167328e-10 -1.505315924067886e-09 ] [ -1.476930577209233e-08 -1.174983631764341e-08 1.088681938764474e-08 ] [ -5.070459983707414e-09 4.268606787582343e-09 -3.849684060913729e-09 ] [ 1.566217509800635e-08 -7.643331353182653e-09 6.447679322404386e-09 ] [ 9.470418979580958e-09 1.545173704779595e-08 -6.958166123270773e-09 ] [ 2.15930295689979e-09 9.022049047467743e-09 1.164165206413284e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -14.711427 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.357030459219672e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4066838 1.6985896 1.3645824 ] [ 1.0346479 3.1262948 5.0812498 ] [ 1.9782711 1.2446378 3.7995467 ] [ 1.3377822 3.5590756 2.6740413 ] [ 4.3243762 1.5740074 2.9593444 ] [ 3.7212869 3.7533268 1.8995502 ] [ 3.3743769 3.426779 4.3676732 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4066838e-10 1.6985896e-10 1.3645824e-10 ] [ 1.0346479e-10 3.1262948e-10 5.081249800000001e-10 ] [ 1.9782711e-10 1.2446378e-10 3.7995467e-10 ] [ 1.3377822e-10 3.5590756e-10 2.6740413e-10 ] [ 4.3243762e-10 1.5740074e-10 2.9593444e-10 ] [ 3.7212869e-10 3.7533268e-10 1.8995502e-10 ] [ 3.3743769e-10 3.426779e-10 4.3676732e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.8e-06 -1.04e-05 2.51e-05 ] [ -3.18e-05 1.25e-05 -2.5e-06 ] [ 1e-07 -1.67e-05 -2.37e-05 ] [ 1.99e-05 5.9e-06 3.9e-06 ] [ 1.1e-06 7e-07 1.5e-06 ] [ -2.4e-05 1.76e-05 -3.52e-05 ] [ 3.29e-05 -9.5e-06 3.1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.8839179412e-15 -1.66626369936e-14 4.02146335134e-14 ] [ -5.09492169612e-14 2.0027207925e-14 -4.005441585e-15 ] [ 1.602176634e-16 -2.67563497878e-14 -3.79715862258e-14 ] [ 3.18833150166e-14 9.452842140600001e-15 6.248488872599999e-15 ] [ 1.7623942974e-15 1.1215236438e-15 2.403264951e-15 ] [ -3.8452239216e-14 2.81983087584e-14 -5.63966175168e-14 ] [ 5.271161125859999e-14 -1.5220678023e-14 4.966747565399999e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.073267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.536527262344328e-18 } }