{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -25.3481555 -0.6098695 23.3976203 ] [ -2.7607556 0.6635491 0.8842945 ] [ 27.1073404 -66.6718993 9.0358843 ] [ 401.1524329 20.5759421 164.4198049 ] [ -400.1508622 46.0422775 -197.7376041 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.061222212250294e-08 -9.771186546389854e-10 3.748712022701548e-08 ] [ -4.423218078062677e-09 1.063122854772881e-09 1.416795973802026e-09 ] [ 4.343074704094732e-08 -1.068201583227919e-07 1.447708257371377e-08 ] [ 6.427170493694207e-07 3.296629338355445e-08 2.634295674072773e-07 ] [ -6.411123562098026e-07 7.376786057888586e-08 -3.168105663420262e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 143.51967 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.299438598989311e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.001147 0.2766576 3.1867936 ] [ -0.225921 2.1166749 2.0566 ] [ 3.180683 -0.0031892 2.0292483 ] [ 3.3799841 1.82627 0.3617845 ] [ 1.1173299 2.8117085 0.0868729 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.001147e-10 2.766576e-11 3.1867936e-10 ] [ -2.25921e-11 2.1166749e-10 2.0566e-10 ] [ 3.180683e-10 -3.1892e-13 2.0292483e-10 ] [ 3.3799841e-10 1.82627e-10 3.617845e-11 ] [ 1.1173299e-10 2.8117085e-10 8.68729e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8e-07 1.3e-06 -8e-07 ] [ 1e-07 -1.1e-06 4e-07 ] [ 8e-07 8e-07 -5e-07 ] [ -4e-07 -1.2e-06 3e-07 ] [ 3e-07 3e-07 6e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.28174129664e-15 2.08282960704e-15 -1.28174129664e-15 ] [ 1.6021766208e-16 -1.76239428288e-15 6.408706483200001e-16 ] [ 1.28174129664e-15 1.28174129664e-15 -8.010883104e-16 ] [ -6.408706483200001e-16 -1.92261194496e-15 4.8065298624e-16 ] [ 4.8065298624e-16 4.8065298624e-16 9.6130597248e-16 ] ] } "relaxed-potential-energy" { "source-value" -15.382547 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.464555717175718e-18 } }