{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.10043 2.130682 2.453785 ] [ 1.948071 1.785129 4.606922 ] [ 2.343053 4.336787 1.957735 ] [ 4.413531 1.079857 2.965455 ] [ 3.524463 3.435576 3.796327 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.10043e-10 2.130682e-10 2.453785e-10 ] [ 1.948071e-10 1.785129e-10 4.606922e-10 ] [ 2.343053e-10 4.336787e-10 1.957735e-10 ] [ 4.413531e-10 1.079857e-10 2.965455e-10 ] [ 3.524463e-10 3.435576e-10 3.796327e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7496663 -2.0895858 -2.8074893 ] [ 1.8904518 -0.8195071 1.4726379 ] [ 0.0655196 1.4756987 -0.4310486 ] [ -3.8329693 2.7737155 1.5796627 ] [ 1.1273316 -1.3403213 0.1862373 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.201097819261639e-09 -3.347885515915665e-09 -4.498093719606158e-09 ] [ 3.028837676709277e-09 -1.312995116199608e-09 2.359426014284009e-09 ] [ 1.049739713241677e-10 2.364329956484953e-09 -6.906159893485709e-10 ] [ -6.141093800704141e-09 4.443982126850582e-09 2.530898646689804e-09 ] [ 1.806184333409057e-09 -2.147431451220263e-09 2.983850479809158e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -14.645205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.346420505782327e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0914005 2.1011747 2.2735124 ] [ 2.2228068 1.6127462 4.6371883 ] [ 2.3716953 4.4412489 1.9173211 ] [ 4.1183132 1.1672635 3.2020784 ] [ 3.5253322 3.4455977 3.7501237 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0914005e-10 2.1011747e-10 2.2735124e-10 ] [ 2.2228068e-10 1.6127462e-10 4.6371883e-10 ] [ 2.3716953e-10 4.4412489e-10 1.9173211e-10 ] [ 4.118313200000001e-10 1.1672635e-10 3.2020784e-10 ] [ 3.5253322e-10 3.4455977e-10 3.7501237e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.91e-05 1.44e-05 8.9e-06 ] [ 1.68e-05 8.1e-06 -1.5e-05 ] [ -1.8e-05 -4.1e-06 -2.08e-05 ] [ -1.92e-05 -6.9e-06 -1.1e-06 ] [ 1.3e-06 -1.15e-05 2.8e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.060157345728e-14 2.307134333952e-14 1.425937192512e-14 ] [ 2.691656722944e-14 1.297763062848e-14 -2.4032649312e-14 ] [ -2.88391791744e-14 -6.568924145279999e-15 -3.332527371264e-14 ] [ -3.076179111936e-14 -1.105501868352e-14 -1.76239428288e-15 ] [ 2.08282960704e-15 -1.84250311392e-14 4.48609453824e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.5414 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.650224435530112e-18 } }