{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.723222 4.526694 1.360574 ] [ 2.417536 3.174257 3.140142 ] [ 3.174903 0.8317717 2.605725 ] [ 4.479997 2.361559 1.640517 ] [ 3.774403 1.830324 4.619346 ] [ 4.138625 4.139223 3.615344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.723222e-10 4.526694e-10 1.360574e-10 ] [ 2.417536e-10 3.174257e-10 3.140142e-10 ] [ 3.174903e-10 8.317717e-11 2.605725e-10 ] [ 4.479997e-10 2.361559e-10 1.640517e-10 ] [ 3.774403e-10 1.830324e-10 4.619346e-10 ] [ 4.138625e-10 4.139223000000001e-10 3.615344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0691609 3.5158976 -5.4326572 ] [ -13.2829401 2.2920361 2.0957187 ] [ -0.8674027 -5.7687624 -1.6019118 ] [ 7.3005355 -2.2219145 -8.9632957 ] [ 1.9307847 -4.3080271 8.7637088 ] [ 6.9881835 6.4907702 5.1384372 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.315161218653486e-09 5.633088935846831e-09 -8.70407635466079e-09 ] [ -2.128161608370681e-08 3.672246653449611e-09 3.357711504913369e-09 ] [ -1.389732326758796e-09 -9.242576248230097e-09 -2.566545634543646e-09 ] [ 1.169674729742044e-08 -3.559899465316522e-09 -1.436078281585717e-08 ] [ 3.093458106138342e-09 -6.902220301392824e-09 1.404100935085922e-08 ] [ 1.119630422556032e-08 1.039936026542534e-08 8.232683949289014e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.12919859 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.069989603383247e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.580539 4.3461437 1.2659087 ] [ 1.1322339 2.7857386 2.4011209 ] [ 2.9972868 1.3207825 2.8609364 ] [ 4.4986975 2.9384003 1.6840654 ] [ 4.0258221 1.9561785 4.9524289 ] [ 5.4741067 3.5165851 3.8171877 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.580539e-10 4.3461437e-10 1.2659087e-10 ] [ 1.1322339e-10 2.7857386e-10 2.4011209e-10 ] [ 2.9972868e-10 1.3207825e-10 2.8609364e-10 ] [ 4.4986975e-10 2.9384003e-10 1.6840654e-10 ] [ 4.0258221e-10 1.9561785e-10 4.9524289e-10 ] [ 5.474106700000001e-10 3.5165851e-10 3.8171877e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.1e-06 4e-06 -1.57e-05 ] [ -1.21e-05 -5.7e-06 2.52e-05 ] [ 6.2e-06 -4.1e-06 -3.1e-06 ] [ 2.03e-05 9.7e-06 -6.4e-06 ] [ -1.65e-05 5e-06 -4.9e-06 ] [ 5.1e-06 -8.9e-06 4.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.96674752448e-15 6.4087064832e-15 -2.515417294656e-14 ] [ -1.938633711168e-14 -9.13240673856e-15 4.037485084416e-14 ] [ 9.93349504896e-15 -6.568924145279999e-15 -4.96674752448e-15 ] [ 3.252418540224e-14 1.554111322176e-14 -1.025393037312e-14 ] [ -2.64359142432e-14 8.010883104e-15 -7.850665441919999e-15 ] [ 8.17110076608e-15 -1.425937192512e-14 7.850665441919999e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.9523637 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.434326782103859e-18 } }