{ "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" [ [ 2.975716 3.919 3.294603 ] [ 5.229011 2.380728 1.260294 ] [ 3.72512 0.5184044 0.8589665 ] [ 3.15133 1.64182 3.064405 ] [ 5.039876 3.004083 3.766304 ] [ 5.090657 4.730463 1.850516 ] [ 3.207695 3.468122 0.7711985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.975716e-10 3.919e-10 3.294603e-10 ] [ 5.229011e-10 2.380728e-10 1.260294e-10 ] [ 3.72512e-10 5.184044e-11 8.589665e-11 ] [ 3.151330000000001e-10 1.64182e-10 3.064405e-10 ] [ 5.039876e-10 3.004083e-10 3.766304e-10 ] [ 5.090657000000001e-10 4.730463000000001e-10 1.850516e-10 ] [ 3.207695e-10 3.468122e-10 7.711985e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.8534435 8.7856978 7.5762876 ] [ 16.6676025 -7.4414483 -12.2265551 ] [ -0.9094179 -6.8186799 -1.913975 ] [ -12.064408 -16.4504999 11.0195508 ] [ 11.3446533 -1.8712954 13.13967 ] [ 9.2631797 15.8703868 -3.4875747 ] [ -10.448166 7.9258389 -14.1074035 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.219566329327372e-08 1.407623961257399e-08 1.213855086517694e-08 ] [ 2.670444305028764e-08 -1.19225144911519e-08 -1.958910073414301e-08 ] [ -1.457048097917033e-09 -1.092472952049888e-08 -3.06652599779568e-09 ] [ -1.932931244139249e-08 -2.635660634025274e-08 1.765526666347794e-08 ] [ 1.817613828834157e-08 -2.998145740490584e-09 2.105207207902714e-08 ] [ 1.484124994960916e-08 2.542716269401292e-08 -5.587710647633574e-09 ] [ -1.673980729543745e-08 1.269859378580719e-08 -2.26025520678921e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 3.7632545 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.029398378020394e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6172015 3.4073459 3.0953306 ] [ 5.9722252 1.3376426 1.9196272 ] [ 3.743519 1.4811889 1.1842608 ] [ 2.2412989 1.0503887 3.0559509 ] [ 6.7327802 3.5119707 2.40605 ] [ 4.992087 5.0392197 1.9814814 ] [ 3.1202932 3.8348639 1.2235862 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6172015e-10 3.4073459e-10 3.0953306e-10 ] [ 5.9722252e-10 1.3376426e-10 1.9196272e-10 ] [ 3.743519e-10 1.4811889e-10 1.1842608e-10 ] [ 2.2412989e-10 1.0503887e-10 3.0559509e-10 ] [ 6.732780199999999e-10 3.5119707e-10 2.40605e-10 ] [ 4.992087e-10 5.0392197e-10 1.9814814e-10 ] [ 3.1202932e-10 3.8348639e-10 1.2235862e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.3e-06 -1.46e-05 -8.7e-06 ] [ -8.6e-06 -1.24e-05 -1.3e-06 ] [ 4e-07 -8e-07 1.1e-06 ] [ -4e-06 1.34e-05 -1.4e-06 ] [ 5e-07 1.08e-05 -2.3e-06 ] [ 1.59e-05 1.84e-05 5.2e-06 ] [ -1.14e-05 -1.48e-05 7.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.169588933184e-14 -2.339177866368e-14 -1.393893660096e-14 ] [ -1.377871893888e-14 -1.986699009792e-14 -2.08282960704e-15 ] [ 6.408706483200001e-16 -1.28174129664e-15 1.76239428288e-15 ] [ -6.4087064832e-15 2.146916671872e-14 -2.24304726912e-15 ] [ 8.010883104e-16 1.730350750464e-14 -3.68500622784e-15 ] [ 2.547460827072e-14 2.948004982272e-14 8.33131842816e-15 ] [ -1.826481347712e-14 -2.371221398784e-14 1.185610699392e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.254682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.604287147893859e-18 } }