{ "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" [ [ 2.750115 2.05781 3.008489 ] [ 2.459373 1.512643 5.182306 ] [ 3.045421 4.403069 3.012822 ] [ 1.351279 3.64529 4.777489 ] [ 4.685264 1.369475 1.888704 ] [ 3.677702 3.202643 0.9471066 ] [ 3.576002 3.111527 4.892003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.750115e-10 2.05781e-10 3.008489e-10 ] [ 2.459373e-10 1.512643e-10 5.182306e-10 ] [ 3.045421e-10 4.403069e-10 3.012822e-10 ] [ 1.351279e-10 3.64529e-10 4.777489e-10 ] [ 4.685264e-10 1.369475e-10 1.888704e-10 ] [ 3.677702e-10 3.202643e-10 9.471066000000001e-11 ] [ 3.576002e-10 3.111527e-10 4.892003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.8226821 -22.3885839 -20.828028 ] [ -67.2728205 -109.0829178 26.8449297 ] [ 1.2973669 13.0098396 -5.8376185 ] [ -14.3217627 8.4325668 1.9408298 ] [ 9.086272 -12.5028011 4.146229 ] [ -1.7433749 14.8852096 -15.1534629 ] [ 88.7770012 107.6466869 8.8871209 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.535073133897065e-08 -3.587046569739929e-08 -3.337017951896778e-08 ] [ -1.07782940220375e-07 -1.747701006278082e-07 4.301031875235957e-08 ] [ 2.078610915779772e-09 2.084406084747802e-08 -9.352895881849564e-09 ] [ -2.294599336658549e-08 1.351046138029427e-08 3.10955213051194e-09 ] [ 1.455781256862966e-08 -2.003169561693252e-08 6.642991168282963e-09 ] [ -2.793194506069538e-09 2.384873481682772e-08 -2.427852398254017e-08 ] [ 1.422364357873736e-07 1.724690050577577e-07 1.423873733220305e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.0176985 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.444794571012323e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7963866 1.8481698 3.0078867 ] [ 2.2028393 1.34555 5.6166712 ] [ 3.0004964 4.698851 3.0145572 ] [ 1.1435143 3.5753467 4.5688281 ] [ 4.7782159 1.0824279 1.4532562 ] [ 3.7325544 3.3887993 0.9049467 ] [ 3.8911492 3.3633123 5.1427735 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7963866e-10 1.8481698e-10 3.0078867e-10 ] [ 2.2028393e-10 1.34555e-10 5.6166712e-10 ] [ 3.0004964e-10 4.698851e-10 3.0145572e-10 ] [ 1.1435143e-10 3.5753467e-10 4.5688281e-10 ] [ 4.778215900000001e-10 1.0824279e-10 1.4532562e-10 ] [ 3.7325544e-10 3.3887993e-10 9.049467e-11 ] [ 3.8911492e-10 3.3633123e-10 5.1427735e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.01e-05 3.6e-06 -1.66e-05 ] [ -1.1e-06 -2.26e-05 3.4e-06 ] [ -2.1e-06 4.73e-05 1.18e-05 ] [ 3.71e-05 -1.24e-05 -2.74e-05 ] [ -5.35e-05 1.01e-05 4.52e-05 ] [ -1.62e-05 -1.74e-05 -2.04e-05 ] [ -2.43e-05 -8.6e-06 4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.629081491008e-14 5.76783583488e-15 -2.659613190528e-14 ] [ -1.76239428288e-15 -3.620919163008e-14 5.44740051072e-15 ] [ -3.36457090368e-15 7.578295416384e-14 1.890568412544e-14 ] [ 5.944075263168e-14 -1.986699009792e-14 -4.389963940992e-14 ] [ -8.57164492128e-14 1.618198387008e-14 7.241838326016e-14 ] [ -2.595526125696e-14 -2.787787320192e-14 -3.268440306432e-14 ] [ -3.893289188544e-14 -1.377871893888e-14 6.4087064832e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.09859 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.861019749224468e-18 } }