{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9740868 0.1188939 -0.8868698 ] [ 0.1303275 -2.5716376 -0.8562047 ] [ -5.6795526 0.8664124 2.4576128 ] [ -8.8441747 5.8975854 -2.9698491 ] [ 3.8506938 -5.1323718 5.2657407 ] [ 6.0926226 -6.1890342 -9.9822701 ] [ 5.4241703 7.0101519 6.9718402 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.560659097589885e-09 1.904890269357331e-10 -1.420922059253572e-09 ] [ 2.08807673547312e-10 -4.120217639890222e-09 -1.371791152959078e-09 ] [ -9.099646392323855e-09 1.388145691251218e-09 3.937529771138826e-09 ] [ -1.416992993461085e-08 9.448973447051415e-09 -4.758222795323921e-09 ] [ 6.169491580219512e-09 -8.222966107213213e-09 8.436646640735027e-09 ] [ 9.761457489077711e-09 -9.915925900571632e-09 -1.599335977673088e-08 ] [ 8.690478841897721e-09 1.12315014824367e-08 1.11701193723936e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -17.927746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.872341550484072e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1955903 2.9445728 1.3430161 ] [ 2.1998551 1.1166168 2.7643303 ] [ 1.3404134 3.3096488 3.9510982 ] [ 2.0434458 5.1591831 2.2071674 ] [ 3.6683531 2.2014854 4.5069311 ] [ 3.7311888 3.1390772 2.0424994 ] [ 3.5717416 4.6999288 4.162551 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1955903e-10 2.9445728e-10 1.3430161e-10 ] [ 2.1998551e-10 1.1166168e-10 2.7643303e-10 ] [ 1.3404134e-10 3.3096488e-10 3.9510982e-10 ] [ 2.0434458e-10 5.1591831e-10 2.2071674e-10 ] [ 3.6683531e-10 2.2014854e-10 4.5069311e-10 ] [ 3.7311888e-10 3.1390772e-10 2.0424994e-10 ] [ 3.5717416e-10 4.699928800000001e-10 4.162551e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.58e-05 5.9e-06 -1.01e-05 ] [ -1.24e-05 6.89e-05 5.4e-06 ] [ -2.46e-05 -1.79e-05 1.26e-05 ] [ 5.72e-05 -4.59e-05 6.3e-06 ] [ 5.69e-05 6.43e-05 -4.84e-05 ] [ -4.47e-05 -1.8e-05 4.11e-05 ] [ -4.82e-05 -5.74e-05 -6.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.531439060864e-14 9.45284206272e-15 -1.618198387008e-14 ] [ -1.986699009792e-14 1.1038996917312e-13 8.65175375232e-15 ] [ -3.941354487168e-14 -2.867896151232001e-14 2.018742542208e-14 ] [ 9.164450270976e-14 -7.353990689472e-14 1.009371271104e-14 ] [ 9.116384972352e-14 1.0301995671744e-13 -7.754534844671999e-14 ] [ -7.161729494976001e-14 -2.88391791744e-14 6.584945911488e-14 ] [ -7.722491312256001e-14 -9.196493803392e-14 -1.105501868352e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.454184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.917992188554143e-18 } }