{ "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" [ [ -6.1577105 0.1378429 5.7632745 ] [ -1.2628015 -0.1191893 2.0655409 ] [ 6.2989345 -26.2239617 7.0644396 ] [ 91.4293058 15.7084584 32.9850083 ] [ -90.3077284 10.4968497 -47.8782633 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.86573980075468e-09 2.208486717232723e-10 9.23378366315281e-09 ] [ -2.023231040011171e-09 -1.909623099095174e-10 3.309361339286191e-09 ] [ 1.009200559185054e-08 -4.201541834049463e-08 1.13184799661737e-08 ] [ 1.464858962087338e-07 2.516772479728937e-08 5.284780913515395e-08 ] [ -1.446889311200362e-07 1.681780718139149e-08 -7.670943410376666e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 26.01979 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.168829921612563e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.081029 0.4227207 2.9731239 ] [ -0.0033311 1.9900892 1.9544334 ] [ 3.0078544 0.2136944 2.0171707 ] [ 3.1143368 1.6518586 0.4076639 ] [ 1.2533338 2.7497589 0.3689076 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.081029e-10 4.227207e-11 2.9731239e-10 ] [ -3.3311e-13 1.9900892e-10 1.9544334e-10 ] [ 3.0078544e-10 2.136944e-11 2.0171707e-10 ] [ 3.1143368e-10 1.6518586e-10 4.076639e-11 ] [ 1.2533338e-10 2.7497589e-10 3.689076e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.98e-05 1.94e-05 3.1e-06 ] [ 4.85e-05 -6e-07 -1.56e-05 ] [ 1.16e-05 -3.17e-05 1.42e-05 ] [ 5e-07 4.52e-05 -2.77e-05 ] [ -2.08e-05 -3.23e-05 2.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.376662950784e-14 3.108222644352e-14 4.96674752448e-15 ] [ 7.77055661088e-14 -9.6130597248e-16 -2.499395528448e-14 ] [ 1.858524880128e-14 -5.078899887936e-14 2.275090801536e-14 ] [ 8.010883104e-16 7.241838326016e-14 -4.438029239616e-14 ] [ -3.332527371264e-14 -5.175030485184e-14 4.16565921408e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.012367 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.924593356786943e-18 } }