{ "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" [ [ 2.026325 2.332401 2.957561 ] [ 3.78119 1.739305 1.09586 ] [ 4.095572 1.356929 3.585425 ] [ 3.432411 4.018052 0.5968462 ] [ 4.864307 3.437474 2.341714 ] [ 3.124173 4.42761 2.898506 ] [ 3.279186 3.336979 4.610213 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.026325e-10 2.332401e-10 2.957561e-10 ] [ 3.78119e-10 1.739305e-10 1.09586e-10 ] [ 4.095572e-10 1.356929e-10 3.585425e-10 ] [ 3.432411e-10 4.018052e-10 5.968462e-11 ] [ 4.864307000000001e-10 3.437474e-10 2.341714e-10 ] [ 3.124173e-10 4.42761e-10 2.898506e-10 ] [ 3.279186e-10 3.336979e-10 4.610213e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.5846196 -5.9202739 -5.5828845 ] [ -1.3113511 -6.2788591 -1.8814813 ] [ 4.2379388 -4.5906488 0.2591372 ] [ -3.9471623 3.270963 -6.818037 ] [ 25.2527489 -5.9144532 -0.7772744 ] [ -16.0765074 25.7154502 -9.6759369 ] [ 3.4289528 -6.2821782 24.476477 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.856060668398145e-08 -9.485324431312437e-09 -8.944767022526696e-09 ] [ -2.101016074080363e-09 -1.005984125531733e-08 -3.014465351332391e-09 ] [ 6.789926465741208e-09 -7.355030181663576e-09 4.151835634195738e-10 ] [ -6.324051155563157e-09 5.240660446101831e-09 -1.092369948114937e-08 ] [ 4.045936389851291e-08 -9.475998641855747e-09 -1.245330871626348e-09 ] [ -2.57574043003982e-08 4.120069310378669e-08 -1.550255988551603e-08 ] [ 5.493788009986698e-09 -1.006515903973943e-08 3.921563920894893e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.6407184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.544613362819639e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7954225 2.159938 3.1154475 ] [ 3.1467207 1.6635081 1.0295457 ] [ 4.2864744 1.273334 3.259378 ] [ 3.9801123 3.982444 0.8901602 ] [ 5.4973613 3.4432196 2.760621 ] [ 2.281053 4.5879565 2.5747928 ] [ 3.6160197 3.5383498 4.45618 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7954225e-10 2.159938e-10 3.1154475e-10 ] [ 3.1467207e-10 1.6635081e-10 1.0295457e-10 ] [ 4.2864744e-10 1.273334e-10 3.259378e-10 ] [ 3.9801123e-10 3.982444e-10 8.901602e-11 ] [ 5.4973613e-10 3.4432196e-10 2.760621e-10 ] [ 2.281053e-10 4.5879565e-10 2.5747928e-10 ] [ 3.6160197e-10 3.5383498e-10 4.45618e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.9e-06 -5.1e-06 2.6e-06 ] [ -3.8e-06 2.79e-05 1.84e-05 ] [ 1.6e-06 -3.51e-05 7.8e-06 ] [ -5.4e-06 -3.5e-06 -1e-07 ] [ 1.22e-05 3.15e-05 -2.48e-05 ] [ 3.31e-05 -1.23e-05 -1.04e-05 ] [ -2.88e-05 -3.3e-06 6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.425937192512e-14 -8.17110076608e-15 4.16565921408e-15 ] [ -6.08827115904e-15 4.470072772032e-14 2.948004982272e-14 ] [ 2.56348259328e-15 -5.623639939008e-14 1.249697764224e-14 ] [ -8.65175375232e-15 -5.6076181728e-15 -1.6021766208e-16 ] [ 1.954655477376e-14 5.04685635552e-14 -3.973398019584e-14 ] [ 5.303204614848e-14 -1.970677243584e-14 -1.666263685632e-14 ] [ -4.614268667904e-14 -5.28718284864e-15 1.057436569728e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }