{ "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" [ [ 0.7742052 0.6824645 0.5764372 ] [ 0.6127639 2.971614 0.4436307 ] [ 0.405499 2.567939 2.589337 ] [ 2.552542 1.167694 2.901906 ] [ 2.397264 1.657583 0.5767519 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.742052e-11 6.824645e-11 5.764372e-11 ] [ 6.127639e-11 2.971614e-10 4.436307e-11 ] [ 4.05499e-11 2.567939e-10 2.589337e-10 ] [ 2.552542e-10 1.167694e-10 2.901906e-10 ] [ 2.397264e-10 1.657583e-10 5.767519e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8128962 -6.6039882 -0.6227315 ] [ -2.1275503 4.3250292 -1.4297204 ] [ 0.0179468 -0.1069393 2.7178686 ] [ -0.9666242 0.9584612 -0.4835842 ] [ 8.889124 1.4274372 -0.1818325 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.313286390777162e-09 -1.058075549807908e-08 -9.977258503357151e-10 ] [ -3.408711350236026e-09 6.929460668517328e-09 -2.290664599160824e-09 ] [ 2.875394337817344e-11 -1.713356463047174e-10 4.354505529326427e-09 ] [ -1.548702694339503e-09 1.535624126583913e-09 -7.747872994282714e-10 ] [ 1.424194665219218e-08 2.287006509500214e-09 -2.91327780401616e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.9273294 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.49662858846049e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.490162 0.3826357 0.8393117 ] [ 1.0543578 3.3782544 0.6697268 ] [ 0.2050726 2.0827155 2.4404077 ] [ 2.5008405 1.6674673 2.7438002 ] [ 2.4918411 1.5362216 0.3948164 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.90162e-11 3.826357e-11 8.393117e-11 ] [ 1.0543578e-10 3.3782544e-10 6.697268e-11 ] [ 2.050726e-11 2.0827155e-10 2.4404077e-10 ] [ 2.5008405e-10 1.6674673e-10 2.7438002e-10 ] [ 2.4918411e-10 1.5362216e-10 3.948164000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.61e-05 -4.5e-06 -1.67e-05 ] [ 5.5e-06 8.3e-06 2e-06 ] [ -2.6e-05 -9.2e-06 8.9e-06 ] [ 2.95e-05 2.1e-05 2.38e-05 ] [ 7.1e-06 -1.56e-05 -1.8e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.579504359488e-14 -7.2097947936e-15 -2.675634956736e-14 ] [ 8.8119714144e-15 1.329806595264e-14 3.2043532416e-15 ] [ -4.16565921408e-14 -1.474002491136e-14 1.425937192512e-14 ] [ 4.72642103136e-14 3.36457090368e-14 3.813180357504e-14 ] [ 1.137545400768e-14 -2.499395528448e-14 -2.88391791744e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }