{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.467571 3.281377 3.110997 ] [ 5.173864 0.7299006 2.779254 ] [ 3.33415 1.630232 1.910302 ] [ 4.266226 2.432899 3.50232 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.467571e-10 3.281377e-10 3.110997e-10 ] [ 5.173864e-10 7.299006000000001e-11 2.779254e-10 ] [ 3.33415e-10 1.630232e-10 1.910302e-10 ] [ 4.266226e-10 2.432899e-10 3.50232e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.3343086 12.572314 4.2911719 ] [ 13.5164064 -12.8661975 0.8258687 ] [ -13.3590691 -11.4601203 -25.4071492 ] [ 13.1769712 11.7540038 20.2901087 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.136391749345238e-08 2.014306756015653e-08 6.875215294013916e-09 ] [ 2.165567033131149e-08 -2.061392083309541e-08 1.323187522990489e-09 ] [ -2.14035881876717e-08 -1.836113681621548e-08 -4.070674044941742e-08 ] [ 2.111183518959492e-08 1.883199008915436e-08 3.250833779263068e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.4823456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.579332705865748e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3739952 3.3689236 2.998616 ] [ 5.246923 0.6682947 2.65282 ] [ 3.171503 1.474754 1.7645183 ] [ 4.4493898 2.5624363 3.8869186 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3739952e-10 3.3689236e-10 2.998616e-10 ] [ 5.246923e-10 6.682947000000001e-11 2.65282e-10 ] [ 3.171503e-10 1.474754e-10 1.7645183e-10 ] [ 4.4493898e-10 2.5624363e-10 3.8869186e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.34e-05 -0.0001009 -0.0001044 ] [ -3.62e-05 4.51e-05 2.22e-05 ] [ 5.45e-05 0.0001931 0.0002296 ] [ -4.9e-06 -0.0001374 -0.0001474 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.146916671872e-14 -1.6165962103872e-13 -1.6726723921152e-13 ] [ -5.799879367296e-14 7.225816559807999e-14 3.556832098176e-14 ] [ 8.731862583360001e-14 3.0938030547648e-13 3.6785975213568e-13 ] [ -7.850665441919999e-15 -2.2013906769792e-13 -2.3616083390592e-13 ] ] } "relaxed-potential-energy" { "source-value" -12.092646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.937455470481064e-18 } }