{ "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" [ [ 0.6628403 2.876785 2.898563 ] [ 2.674482 0.2424727 1.042802 ] [ 2.274992 1.1385 2.859862 ] [ 1.854823 2.68523 0.2527791 ] [ 2.130586 2.70202 1.965626 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.628403e-11 2.876785e-10 2.898563e-10 ] [ 2.674482e-10 2.424727e-11 1.042802e-10 ] [ 2.274992e-10 1.1385e-10 2.859862e-10 ] [ 1.854823e-10 2.68523e-10 2.527791e-11 ] [ 2.130586e-10 2.70202e-10 1.965626e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -22.6748648 5.8553828 15.1003048 ] [ 0.9971569 -2.8203699 -5.7719604 ] [ 4.0841691 -18.6425488 16.3707675 ] [ -2.2554342 -0.2072726 -30.3873996 ] [ 19.848973 15.8148084 4.6882877 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.632913826236087e-08 9.381357427994443e-09 2.419335531751402e-08 ] [ 1.597621472449403e-09 -4.518730715788034e-09 -9.247700009063418e-09 ] [ 6.543560247413778e-09 -2.98686558394831e-08 2.622886095305247e-08 ] [ -3.613603944992751e-09 -3.320873138524301e-10 -4.868598120602727e-08 ] [ 3.180156048749044e-08 2.533811628091145e-08 7.511464944524204e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 8.5780275 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.374351511307947e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4494476 2.7468804 3.6478222 ] [ 2.452021 0.1597364 0.7451794 ] [ 2.1345303 1.047535 2.944972 ] [ 2.4400233 2.321679 -0.2233013 ] [ 2.1217011 3.3691769 1.9049599 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.494476e-11 2.7468804e-10 3.6478222e-10 ] [ 2.452021e-10 1.597364e-11 7.451794e-11 ] [ 2.1345303e-10 1.047535e-10 2.944972e-10 ] [ 2.4400233e-10 2.321679e-10 -2.233013e-11 ] [ 2.1217011e-10 3.3691769e-10 1.9049599e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.54e-05 -2.08e-05 -1.71e-05 ] [ -1.83e-05 8e-07 -1.76e-05 ] [ 2.6e-06 3.35e-05 1.24e-05 ] [ 1.18e-05 -1.52e-05 8e-06 ] [ -1.16e-05 1.7e-06 1.43e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.467351996032e-14 -3.332527371264e-14 -2.739722021568e-14 ] [ -2.931983216064e-14 1.28174129664e-15 -2.819830852608e-14 ] [ 4.16565921408e-15 5.36729167968e-14 1.986699009792e-14 ] [ 1.890568412544e-14 -2.435308463616e-14 1.28174129664e-14 ] [ -1.858524880128e-14 2.72370025536e-15 2.291112567744e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.268028 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.805337102411978e-18 } }