{ "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" [ [ 2.69276 0.7489354 1.12344 ] [ 2.32609 2.279725 3.013569 ] [ 2.388377 0.2175567 3.770382 ] [ 2.168931 2.205605 5.63033 ] [ 4.69019 0.7206414 2.589749 ] [ 3.957875 2.675588 1.380487 ] [ 4.50812 1.505291 4.661584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.69276e-10 7.489354e-11 1.12344e-10 ] [ 2.32609e-10 2.279725e-10 3.013569e-10 ] [ 2.388377e-10 2.175567e-11 3.770382e-10 ] [ 2.168931e-10 2.205605e-10 5.63033e-10 ] [ 4.690190000000001e-10 7.206414e-11 2.589749e-10 ] [ 3.957875e-10 2.675588e-10 1.380487e-10 ] [ 4.50812e-10 1.505291e-10 4.661584000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8855382 -2.875269 -2.8234034 ] [ -4.4545868 6.7863164 1.1723643 ] [ -0.8901337 -4.3407518 2.6994046 ] [ 1.0480339 -0.8906112 -0.4137476 ] [ 4.2681948 -3.0497544 -2.2624646 ] [ 2.5144623 3.0728619 -2.4110834 ] [ -0.6004324 1.2972081 4.0389301 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.020965221665315e-09 -4.606688770310995e-09 -4.523590918567231e-09 ] [ -7.137034826284286e-09 1.087287747743162e-08 1.878334672520557e-09 ] [ -1.426151403526201e-09 -6.954651050655517e-09 4.324922940199975e-09 ] [ 1.679135412385845e-09 -1.426916442862633e-09 -6.6289673163211e-10 ] [ 6.838401921580132e-09 -4.886245198861931e-09 -3.624867887507624e-09 ] [ 4.028612710942995e-09 4.923267495127068e-09 -3.862981454278974e-09 ] [ -9.619987536508338e-10 2.078356490132388e-09 6.471079379265405e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.809111 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.333987114383211e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3881212 0.7650428 1.4202083 ] [ 2.7333883 2.76516 3.1415783 ] [ 2.6043576 -0.0185199 3.8446153 ] [ 1.914076 1.8337486 5.3837043 ] [ 4.7546529 0.8149872 2.5323967 ] [ 3.9994757 2.5788662 0.9216124 ] [ 4.3382713 1.6140576 4.9254258 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3881212e-10 7.650428000000001e-11 1.4202083e-10 ] [ 2.7333883e-10 2.76516e-10 3.1415783e-10 ] [ 2.6043576e-10 -1.85199e-12 3.8446153e-10 ] [ 1.914076e-10 1.8337486e-10 5.3837043e-10 ] [ 4.7546529e-10 8.149872e-11 2.5323967e-10 ] [ 3.9994757e-10 2.5788662e-10 9.216124e-11 ] [ 4.3382713e-10 1.6140576e-10 4.925425800000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.46e-05 3.6e-06 8.5e-06 ] [ 5.3e-06 -4.2e-06 -4.5e-06 ] [ -3e-06 -2e-06 -9.7e-06 ] [ -1.19e-05 2e-06 4.9e-06 ] [ -1.72e-05 1.15e-05 -6.1e-06 ] [ -2.9e-06 -1.22e-05 9.9e-06 ] [ 1.51e-05 1.1e-06 -3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.339177866368e-14 5.76783583488e-15 1.36185012768e-14 ] [ 8.491536090240001e-15 -6.72914180736e-15 -7.2097947936e-15 ] [ -4.8065298624e-15 -3.2043532416e-15 -1.554111322176e-14 ] [ -1.906590178752e-14 3.2043532416e-15 7.850665441919999e-15 ] [ -2.755743787776e-14 1.84250311392e-14 -9.77327738688e-15 ] [ -4.646312200320001e-15 -1.954655477376e-14 1.586154854592e-14 ] [ 2.419286697408e-14 1.76239428288e-15 -4.8065298624e-15 ] ] } "relaxed-potential-energy" { "source-value" -23.579661 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.777878158058956e-18 } }