{ "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" [ [ 0.09862 0.3102875 1.608695 ] [ 0.216089 2.435481 0.8089597 ] [ 1.587261 0.9923217 0.3598848 ] [ 2.442881 2.780277 0.9615339 ] [ 1.769015 1.574471 2.844855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.862e-12 3.102875e-11 1.608695e-10 ] [ 2.16089e-11 2.435481e-10 8.089597e-11 ] [ 1.587261e-10 9.923217e-11 3.598848e-11 ] [ 2.442881e-10 2.780277e-10 9.615339e-11 ] [ 1.769015e-10 1.574471e-10 2.844855e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.5168623 -8.8467094 4.2728954 ] [ -14.1723539 11.8199328 -5.5126465 ] [ 6.9908689 -10.8183028 -14.3764149 ] [ 9.0738789 8.5825291 -0.5222628 ] [ 5.6244684 -0.7374497 16.1384289 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.204334103883292e-08 -1.41739909716916e-08 6.845933113003866e-09 ] [ -2.27066140802837e-08 1.893761999158708e-08 -8.832233341034947e-09 ] [ 1.120060671065781e-08 -1.733283182289518e-08 -2.303355584370077e-08 ] [ 1.453795663355042e-08 1.375072747135567e-08 -8.367572480735463e-10 ] [ 9.011391774908382e-09 -1.181524668355974e-09 2.585661348002306e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 7.5030423 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.202119895793346e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.096829 0.4342673 1.6479088 ] [ -0.2048178 2.847684 0.8585167 ] [ 2.0070749 0.4904688 -0.0510658 ] [ 2.3487161 2.8028682 0.9856598 ] [ 1.8660637 1.5175499 3.142909 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.6829e-12 4.342673e-11 1.6479088e-10 ] [ -2.048178e-11 2.847684e-10 8.585167e-11 ] [ 2.0070749e-10 4.904688e-11 -5.106580000000001e-12 ] [ 2.3487161e-10 2.8028682e-10 9.856598e-11 ] [ 1.8660637e-10 1.5175499e-10 3.142909e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.7e-06 2.1e-06 1.2e-06 ] [ 3.7e-06 -4.9e-06 -1.6e-06 ] [ -5.3e-06 4.5e-06 2.7e-06 ] [ -4e-07 -2.5e-06 4.2e-06 ] [ -1.7e-06 8e-07 -6.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.928053496960001e-15 3.36457090368e-15 1.92261194496e-15 ] [ 5.928053496960001e-15 -7.850665441919999e-15 -2.56348259328e-15 ] [ -8.491536090240001e-15 7.2097947936e-15 4.32587687616e-15 ] [ -6.408706483200001e-16 -4.005441552e-15 6.72914180736e-15 ] [ -2.72370025536e-15 1.28174129664e-15 -1.04141480352e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.4498528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.033380336376142e-18 } }