{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1379706 -5.2928135 -1.387995 ] [ -8.1052864 -7.6209065 -0.5419654 ] [ -11.3967128 2.5903938 9.1125889 ] [ -2.2142274 5.2835753 0.3044961 ] [ 3.872748 -2.476655 -6.8263411 ] [ 13.154508 -2.7902242 5.4354848 ] [ 5.8269413 10.3066302 -6.0962683 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.823229890477749e-09 -8.480022047954622e-09 -2.223813138787296e-09 ] [ -1.29861003749682e-08 -1.221003822360276e-08 -8.683242931625204e-10 ] [ -1.825954680213211e-08 4.150268385025272e-09 1.459997689054159e-08 ] [ -3.54758337341477e-09 8.465220819896347e-09 4.878565325447789e-10 ] [ 6.204826303849958e-09 -3.968038738787424e-09 -1.093700411602615e-08 ] [ 2.107584517572657e-08 -4.470431980030384e-09 8.708606669273765e-09 ] [ 9.335789121633958e-09 1.651304194567123e-08 -9.767298544384162e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2328082 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.479258944237053e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0513641 1.687931 1.8200487 ] [ 2.1374888 0.1620545 3.5064275 ] [ 2.4133953 2.0019041 5.0790556 ] [ 1.6764504 3.5740764 3.370394 ] [ 4.5969129 0.1849525 2.9563842 ] [ 4.719182 2.2842337 4.3455931 ] [ 4.0596915 4.1608066 2.797889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0513641e-10 1.687931e-10 1.8200487e-10 ] [ 2.1374888e-10 1.620545e-11 3.5064275e-10 ] [ 2.4133953e-10 2.0019041e-10 5.0790556e-10 ] [ 1.6764504e-10 3.5740764e-10 3.370394e-10 ] [ 4.596912900000001e-10 1.849525e-11 2.9563842e-10 ] [ 4.719182e-10 2.2842337e-10 4.3455931e-10 ] [ 4.0596915e-10 4.1608066e-10 2.797889e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.2e-06 2.1e-06 1.9e-06 ] [ 2.7e-06 -3.5e-06 -9.9e-06 ] [ -3.9e-06 1.58e-05 -8.8e-06 ] [ -1.06e-05 8.4e-06 1.27e-05 ] [ 1.2e-06 -1.28e-05 -1e-07 ] [ 1.29e-05 6.8e-06 1.2e-06 ] [ -1.15e-05 -1.68e-05 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.474002491136e-14 3.36457090368e-15 3.04413557952e-15 ] [ 4.32587687616e-15 -5.6076181728e-15 -1.586154854592e-14 ] [ -6.24848882112e-15 2.531439060864e-14 -1.409915426304e-14 ] [ -1.698307218048e-14 1.345828361472e-14 2.034764308416e-14 ] [ 1.92261194496e-15 -2.050786074624e-14 -1.6021766208e-16 ] [ 2.066807840832e-14 1.089480102144e-14 1.92261194496e-15 ] [ -1.84250311392e-14 -2.691656722944e-14 4.96674752448e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.894908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.347733309136689e-18 } }