{ "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" [ [ 2.06977 2.12479 1.528563 ] [ 2.041317 1.533814 3.912889 ] [ 1.700439 5.299543 2.410292 ] [ 0.6511626 3.199571 3.041419 ] [ 2.983959 3.688065 3.444542 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.06977e-10 2.12479e-10 1.528563e-10 ] [ 2.041317e-10 1.533814e-10 3.912889e-10 ] [ 1.700439e-10 5.299543e-10 2.410292e-10 ] [ 6.511626e-11 3.199571e-10 3.041419e-10 ] [ 2.983959e-10 3.688065e-10 3.444542e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4486462 -0.8342824 -1.6916117 ] [ 0.3650256 -1.4191665 1.2284305 ] [ -0.5181679 0.5631489 -0.0919336 ] [ -2.7538745 1.0095712 -0.1933071 ] [ 2.4583706 0.6807287 0.7484218 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.188104526507609e-10 -1.336667756424914e-09 -2.710260717211743e-09 ] [ 5.848354823134925e-10 -2.273755387322563e-09 1.968162627377655e-09 ] [ -8.301964950290324e-10 9.022640016092371e-10 -1.472938645859789e-10 ] [ -4.41219334051729e-09 1.617511373673001e-09 -3.097121162546477e-10 ] [ 3.938743900582068e-09 1.090647608247577e-09 1.199103910457053e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2828817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.487281603339216e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2249135 2.0857619 1.4960987 ] [ 1.897808 1.9446703 4.1589747 ] [ 1.6004859 5.106652 2.9346838 ] [ 0.2914481 3.1273559 2.6690474 ] [ 3.4319921 3.5813428 3.0789004 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2249135e-10 2.0857619e-10 1.4960987e-10 ] [ 1.897808e-10 1.9446703e-10 4.1589747e-10 ] [ 1.6004859e-10 5.106652000000001e-10 2.9346838e-10 ] [ 2.914481e-11 3.1273559e-10 2.669047400000001e-10 ] [ 3.4319921e-10 3.5813428e-10 3.0789004e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.24e-05 1.23e-05 2.7e-06 ] [ -2.15e-05 1.1e-05 1.31e-05 ] [ 1.25e-05 3.1e-05 1.83e-05 ] [ -8.3e-06 -4.07e-05 -5e-06 ] [ 4.9e-06 -1.35e-05 -2.91e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.986699009792e-14 1.970677243584e-14 4.32587687616e-15 ] [ -3.44467973472e-14 1.76239428288e-14 2.098851373248e-14 ] [ 2.002720776e-14 4.96674752448e-14 2.931983216064e-14 ] [ -1.329806595264e-14 -6.520858846656e-14 -8.010883104e-15 ] [ 7.850665441919999e-15 -2.16293843808e-14 -4.662333966527999e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.393797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.665269855474118e-18 } }