{ "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" [ [ 1.558502 1.467528 2.474942 ] [ 1.379624 2.873279 4.407553 ] [ 1.24144 3.597751 1.918679 ] [ 3.591005 1.301821 3.64335 ] [ 3.465479 3.687448 2.931727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.558502e-10 1.467528e-10 2.474942e-10 ] [ 1.379624e-10 2.873279e-10 4.407553e-10 ] [ 1.24144e-10 3.597751e-10 1.918679e-10 ] [ 3.591005e-10 1.301821e-10 3.64335e-10 ] [ 3.465479e-10 3.687448e-10 2.931727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3685025 -2.9611729 0.0806865 ] [ 1.8418203 -0.129656 -1.0601319 ] [ 0.296894 2.0305819 0.0825544 ] [ -0.9798088 1.8170118 0.1171113 ] [ -0.790403 -0.7567649 0.7797796 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.904060902063521e-10 -4.744321990526537e-09 1.292740239141792e-10 ] [ 2.950921424374842e-09 -2.077318119464448e-10 -1.698518545144284e-09 ] [ 4.756766256557952e-10 3.253350846799644e-09 1.322667296241715e-10 ] [ -1.569826752214103e-09 2.911173825677726e-09 1.87632986891495e-10 ] [ -1.266365207610182e-09 -1.21247103022205e-09 1.249344644496776e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.979055 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.079473848107735e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3522676 1.2102856 2.4595418 ] [ 1.5615999 2.854672 4.3068308 ] [ 1.3537647 3.580527 1.9424589 ] [ 3.4834632 1.4560508 3.5922459 ] [ 3.4849546 3.8262916 3.0751735 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3522676e-10 1.2102856e-10 2.4595418e-10 ] [ 1.5615999e-10 2.854672e-10 4.3068308e-10 ] [ 1.3537647e-10 3.580527e-10 1.9424589e-10 ] [ 3.4834632e-10 1.4560508e-10 3.5922459e-10 ] [ 3.4849546e-10 3.8262916e-10 3.0751735e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.83e-05 3.89e-05 -1.9e-06 ] [ 2.72e-05 -3.5e-06 -1.15e-05 ] [ 2.28e-05 -3.58e-05 2.77e-05 ] [ -4.47e-05 3.1e-05 -8.1e-06 ] [ -3.35e-05 -3.06e-05 -6.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.534159836864e-14 6.232467054911999e-14 -3.04413557952e-15 ] [ 4.357920408576e-14 -5.6076181728e-15 -1.84250311392e-14 ] [ 3.652962695424e-14 -5.735792302464001e-14 4.438029239616e-14 ] [ -7.161729494976001e-14 4.96674752448e-14 -1.297763062848e-14 ] [ -5.36729167968e-14 -4.902660459647999e-14 -9.93349504896e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.867937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.221888444012729e-18 } }