{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.39198 0 0 ] "si-unit" "m" "si-value" [ 5.39198e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0815956 5.53401 0 ] "si-unit" "m" "si-value" [ 8.15956e-12 5.534010000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109849 -0.0410552 5.55668 ] "si-unit" "m" "si-value" [ -1.09849e-11 -4.10552e-12 5.55668e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0600222 -0.0188866 -0.0475744 ] [ 1.35953 1.30974 1.45574 ] [ -0.0201429 2.70129 2.75612 ] [ 1.43727 3.87805 4.08993 ] [ 2.67575 -0.0837777 2.76281 ] [ 3.98871 1.3119 4.2787 ] [ 2.73779 2.77507 0.256836 ] [ 4.26747 4.05038 1.42682 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.00222e-12 -1.88866e-12 -4.75744e-12 ] [ 1.35953e-10 1.30974e-10 1.45574e-10 ] [ -2.01429e-12 2.70129e-10 2.75612e-10 ] [ 1.43727e-10 3.87805e-10 4.08993e-10 ] [ 2.67575e-10 -8.37777e-12 2.76281e-10 ] [ 3.98871e-10 1.3119e-10 4.2787e-10 ] [ 2.73779e-10 2.77507e-10 2.56836e-11 ] [ 4.26747e-10 4.05038e-10 1.42682e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.6446821000000007 -2.0594902000000004 0.11131280000000003 ] [ -1.0331521000000001 -0.33106520000000006 -0.8574978000000002 ] [ 0.4210652000000001 -2.2526147000000005 1.7132233000000003 ] [ -1.1251736000000003 3.294973400000001 1.5625878000000004 ] [ 0.9457440000000003 -0.8813329000000002 1.0397279000000001 ] [ -1.4958739000000003 1.5956258000000005 -1.3852399000000002 ] [ 0.7406305000000001 -1.4470174000000002 -2.1015150000000005 ] [ -2.0979222000000006 2.0809213000000004 -0.08259910000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.839424450868249e-09 -3.299667049206717e-09 1.783427657557863e-10 ] [ -1.655292140350424e-09 -5.304249234004763e-10 -1.373862927547435e-09 ] [ 6.746208192724763e-10 -3.609086608010407e-09 2.744886317469825e-09 ] [ -1.802726836261371e-09 5.279129347637888e-09 2.503541641107307e-09 ] [ 1.515248926061876e-09 -1.412050967521865e-09 1.665827733373481e-09 ] [ -2.396654190244918e-09 2.556474352305297e-09 -2.21939898197933e-09 ] [ 1.186620871751415e-09 -2.318377448170802e-09 -3.366998201260513e-09 ] [ -3.361241901097303e-09 3.334003456584744e-09 -1.323383469191213e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.684131 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.717228042176453e-18 } }