{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3945311 -0.0926341 -3.3653931 ] [ -3.2467009 -5.3500813 3.8669662 ] [ -3.1885503 2.5080362 2.5705702 ] [ 1.7019256 -4.5911568 -5.1416553 ] [ 3.1505949 -2.9639874 1.9884033 ] [ 3.7296974 6.3101526 -3.9852711 ] [ 1.2475646 4.1796708 4.0663799 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.438638366998507e-09 -1.484161893088493e-10 -5.391954144621637e-09 ] [ -5.201788276710319e-09 -8.571775178239272e-09 6.195562839063817e-09 ] [ -5.108620744904827e-09 4.018316963760073e-09 4.118507476565181e-09 ] [ 2.726785406661013e-09 -7.355844087386941e-09 -8.23783991387241e-09 ] [ 5.047809490391714e-09 -4.748831316625779e-09 3.185773279981569e-09 ] [ 5.975633976938546e-09 1.010997896940033e-08 -6.385108183969899e-09 ] [ 1.998818835057704e-09 6.696570838400433e-09 6.515058807071042e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.06718 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.253810691658535e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9017105 2.6216415 1.0720098 ] [ 2.8191524 1.2712215 4.3723562 ] [ 1.8887079 3.1990407 3.3653463 ] [ 4.2132547 2.1258149 1.0097587 ] [ 4.4293554 0.5277693 2.740601 ] [ 5.175832 4.1208264 1.8402033 ] [ 3.5655892 4.8642647 3.4719256 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9017105e-10 2.6216415e-10 1.0720098e-10 ] [ 2.8191524e-10 1.2712215e-10 4.3723562e-10 ] [ 1.8887079e-10 3.1990407e-10 3.3653463e-10 ] [ 4.2132547e-10 2.1258149e-10 1.0097587e-10 ] [ 4.429355400000001e-10 5.277693e-11 2.740601e-10 ] [ 5.175832e-10 4.120826400000001e-10 1.8402033e-10 ] [ 3.5655892e-10 4.864264699999999e-10 3.4719256e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.29e-05 -1.55e-05 -2.18e-05 ] [ -2.31e-05 1.5e-06 -2.08e-05 ] [ 1.3e-05 -5.7e-06 2.07e-05 ] [ -3e-07 -2.23e-05 -3.13e-05 ] [ 1.95e-05 2e-05 1.94e-05 ] [ -8.2e-06 -1.2e-06 1.18e-05 ] [ 2.21e-05 2.33e-05 2.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.668984461632e-14 -2.48337376224e-14 -3.492745033344e-14 ] [ -3.701027994048e-14 2.4032649312e-15 -3.332527371264e-14 ] [ 2.08282960704e-14 -9.13240673856e-15 3.316505605055999e-14 ] [ -4.8065298624e-16 -3.572853864384e-14 -5.014812823104e-14 ] [ 3.12424441056e-14 3.2043532416e-14 3.108222644352e-14 ] [ -1.313784829056e-14 -1.92261194496e-15 1.890568412544e-14 ] [ 3.540810331968e-14 3.733071526464e-14 3.508766799552e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }