{ "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" [ 5.56756 0 0 ] "si-unit" "m" "si-value" [ 5.56756e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.603325 5.38792 0 ] "si-unit" "m" "si-value" [ 6.033250000000001e-11 5.387920000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.402741 -0.450618 5.48706 ] "si-unit" "m" "si-value" [ -4.02741e-11 -4.50618e-11 5.48706e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.336492 0.0638405 0.189929 ] [ 1.53887 1.35333 1.11771 ] [ 0.318438 2.15889 3.01891 ] [ 1.68585 3.81794 4.45016 ] [ 2.72641 -0.320403 2.65546 ] [ 4.33601 0.74819 4.56114 ] [ 3.14234 2.88247 0.0769818 ] [ 4.12798 3.93896 1.35009 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.36492e-11 6.38405e-12 1.89929e-11 ] [ 1.53887e-10 1.35333e-10 1.11771e-10 ] [ 3.18438e-11 2.15889e-10 3.01891e-10 ] [ 1.68585e-10 3.81794e-10 4.45016e-10 ] [ 2.72641e-10 -3.20403e-11 2.65546e-10 ] [ 4.33601e-10 7.481900000000001e-11 4.56114e-10 ] [ 3.14234e-10 2.88247e-10 7.698180000000001e-12 ] [ 4.12798e-10 3.93896e-10 1.35009e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.0742578000000003 -2.2726950000000006 1.7345144000000003 ] [ -0.14171610000000004 -0.9521086000000002 2.1649404000000003 ] [ -0.32936070000000006 1.4619410000000002 -0.062128900000000015 ] [ -2.0988653000000004 1.6827877000000004 -3.8855416000000007 ] [ -2.5051111000000006 2.5468255000000006 3.3771221000000007 ] [ -2.3830503000000003 3.115539000000001 -4.1735221000000005 ] [ -0.13933160000000003 -5.055476900000001 0.047183900000000015 ] [ 5.523177200000001 -0.5268128000000001 0.7974318000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.323327352672043e-09 -3.641258795209057e-09 2.77899842012094e-09 ] [ -2.27054222210955e-10 -1.525446139382619e-09 3.468616894305401e-09 ] [ -5.276940133503226e-10 2.342287691188973e-09 -9.954147105602115e-11 ] [ -3.362752913868379e-09 2.696123110709805e-09 -6.225323910665827e-09 ] [ -4.013630436926572e-09 4.080464273357272e-09 5.410746074207001e-09 ] [ -3.818067476850426e-09 4.991643746990613e-09 -6.686719535012121e-09 ] [ -2.232338320586573e-10 -8.099766896174462e-09 7.559694145816514e-11 ] [ 8.849105382375608e-09 -8.440471516981864e-10 1.277626586642462e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.019978 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.649513028773034e-18 } }