{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7607129 0.1029019 2.480933 ] [ 0.9158836 2.552597 0.2381701 ] [ 0.8989231 2.268448 2.632769 ] [ 2.109562 0.2713555 0.0459784 ] [ 2.969591 1.985029 0.1686784 ] [ 2.973458 2.362165 2.304699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.607129000000001e-11 1.029019e-11 2.480933e-10 ] [ 9.158836e-11 2.552597e-10 2.381701e-11 ] [ 8.989231e-11 2.268448e-10 2.632769e-10 ] [ 2.109562e-10 2.713555e-11 4.59784e-12 ] [ 2.969591e-10 1.985029e-10 1.686784e-11 ] [ 2.973458e-10 2.362165e-10 2.304699e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6452 -0.4221779 -2.6605625 ] [ -3.6299259 0.2248384 -0.8969339 ] [ -1.7322614 1.1891964 -0.5734346 ] [ -3.3122607 -3.853832 2.2154713 ] [ 3.6019995 3.3151784 -0.5643198 ] [ 3.4272485 -0.4532033 2.4797795 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.635900998256799e-09 -6.764035667711885e-10 -4.262691070796625e-09 ] [ -5.81578246013142e-09 3.602308309059456e-10 -1.437046536822492e-09 ] [ -2.775388739060128e-09 1.905302685316917e-09 -9.187435172471363e-10 ] [ -5.306826699256483e-09 -6.174519581761488e-09 3.549576350157604e-09 ] [ 5.771039434579682e-09 5.311501370021505e-09 -9.041399976635532e-10 ] [ 5.491057465611548e-09 -7.261117377116921e-10 3.973044772372202e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.460467719227609 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.156604686245774e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3407866 0.2056032 2.4146144 ] [ 0.8048026 2.4689048 0.1946215 ] [ 0.5693152 2.5074529 2.5271839 ] [ 1.7201855 0.2246788 0.1071854 ] [ 3.2284779 2.1298164 0.1505376 ] [ 2.9645629 2.0060403 2.477085 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3407866e-10 2.056032e-11 2.4146144e-10 ] [ 8.048026000000001e-11 2.4689048e-10 1.946215e-11 ] [ 5.693152e-11 2.5074529e-10 2.5271839e-10 ] [ 1.7201855e-10 2.246788e-11 1.071854e-11 ] [ 3.2284779e-10 2.1298164e-10 1.505376e-11 ] [ 2.9645629e-10 2.0060403e-10 2.477085000000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.82e-05 -6.6e-06 -3.47e-05 ] [ 3.27e-05 0.0 2.91e-05 ] [ 1.75e-05 -8.7e-06 -2.84e-05 ] [ -2.23e-05 1.29e-05 2.49e-05 ] [ -2.73e-05 -2.27e-05 3.92e-05 ] [ -2.89e-05 2.5e-05 -3.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.51813810788e-14 -1.05743657844e-14 -5.55955291998e-14 ] [ 5.23911759318e-14 0.0 4.66233400494e-14 ] [ 2.8038091095e-14 -1.39389367158e-14 -4.550181640559999e-14 ] [ -3.572853893819999e-14 2.06680785786e-14 3.989419818659999e-14 ] [ -4.37394221082e-14 -3.636940959179999e-14 6.280532405279998e-14 ] [ -4.63029047226e-14 4.005441585e-14 -4.838573434679999e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.509304719227607 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.64508222647324e-18 } }