{ "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" [ [ 0.223645 0.1945873 1.126976 ] [ 0.7288277 2.388611 0.0814776 ] [ 2.404153 0.5300895 0.5572584 ] [ 2.145602 0.6403931 2.690423 ] [ 2.26761 2.998114 1.480003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.23645e-11 1.945873e-11 1.126976e-10 ] [ 7.288277e-11 2.388611e-10 8.14776e-12 ] [ 2.404153e-10 5.300895e-11 5.572584000000001e-11 ] [ 2.145602e-10 6.403931000000001e-11 2.690423e-10 ] [ 2.26761e-10 2.998114e-10 1.480003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1273892 0.2881039 -0.8818026 ] [ -1.9511009 -1.3486313 -0.6659761 ] [ 2.0338419 -0.3735693 -3.1289664 ] [ 0.3119556 0.3036594 3.437127 ] [ 1.7326926 1.1304373 1.2396182 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.408453267663953e-09 4.615933367442726e-10 -1.412803521520448e-09 ] [ -3.12600827255637e-09 -2.160745556741044e-09 -1.067011346222447e-09 ] [ 3.258573969430165e-09 -5.985240036397362e-10 -5.013156854651097e-09 ] [ 4.998079731654503e-10 4.865159953744595e-10 5.506884567490517e-09 ] [ 2.776079597624708e-09 1.811160228262048e-09 1.986087315121139e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.6457056 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.224977086276295e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4560816 0.4826899 0.1843361 ] [ 0.3139938 2.7726948 0.1246061 ] [ 1.9095998 -0.770503 1.4431774 ] [ 3.3501187 0.0033104 3.0537456 ] [ 1.7400438 4.2636028 1.1302727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.560816e-11 4.826899e-11 1.843361e-11 ] [ 3.139938e-11 2.7726948e-10 1.246061e-11 ] [ 1.9095998e-10 -7.705030000000001e-11 1.4431774e-10 ] [ 3.3501187e-10 3.3104e-13 3.0537456e-10 ] [ 1.7400438e-10 4.2636028e-10 1.1302727e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.89e-05 3.4e-05 4.41e-05 ] [ -3.54e-05 -8.21e-05 -1.93e-05 ] [ -4.19e-05 -5.15e-05 -5.95e-05 ] [ -1.47e-05 7.12e-05 -2.2e-06 ] [ 5.31e-05 2.84e-05 3.7e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.232467106259999e-14 5.447400555599999e-14 7.06559895594e-14 ] [ -5.671705284359999e-14 -1.315387016514e-13 -3.09220090362e-14 ] [ -6.713120096459999e-14 -8.251209665099998e-14 -9.5329509723e-14 ] [ -2.35519965198e-14 1.140749763408e-13 -3.5247885948e-15 ] [ 8.507557926539999e-14 4.550181640559999e-14 5.9280535458e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.663724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.708516942422502e-18 } }