{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.5417e-10 0.0 0.0 ] "source-value" [ 5.5417 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -8.77832e-12 5.55439e-10 0.0 ] "source-value" [ -0.0877832 5.55439 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.08884e-12 4.074500000000001e-12 5.63916e-10 ] "source-value" [ 0.0308884 0.040745 5.63916 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 3.043618076471482e-09 1.462000105416601e-09 -2.293896990493288e-09 ] [ -1.036747022152961e-09 -3.088629626456237e-10 -7.712745271871673e-10 ] [ -1.387728644676824e-09 -5.097650160929222e-10 -2.282765227549632e-09 ] [ -4.642479793843047e-10 2.962961301027168e-09 2.91888926741285e-09 ] [ 9.424262436158168e-10 -1.561797764514288e-09 1.385671289678054e-09 ] [ 8.837188072234771e-10 -1.872466700646878e-09 -1.430615388027074e-09 ] [ -1.386653423946605e-09 2.992569524979552e-10 -6.43886425373332e-10 ] [ -5.943858969324192e-10 -4.713259150420128e-10 3.11787800153959e-09 ] ] "source-value" [ [ 1.899677 0.9125087 -1.4317379 ] [ -0.6470866 -0.1927771 -0.4813917 ] [ -0.8661521 -0.3181703 -1.42479 ] [ -0.2897608 1.849335 1.8218274 ] [ 0.5882162 -0.9747975 0.864868 ] [ 0.5515739 -1.1687018 -0.8929199 ] [ -0.865481 0.1867815 -0.4018823 ] [ -0.3709865 -0.2941785 1.9460264 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.59411e-11 -8.747230000000001e-12 -7.74134e-13 ] [ 1.28203e-10 1.40365e-10 1.4018e-10 ] [ -7.44566e-12 2.77196e-10 2.86869e-10 ] [ 1.41795e-10 4.01233e-10 4.00515e-10 ] [ 2.72183e-10 1.05785e-11 2.67146e-10 ] [ 4.038e-10 1.47487e-10 4.29534e-10 ] [ 2.69485e-10 2.74872e-10 1.00738e-12 ] [ 4.0446e-10 4.150070000000001e-10 1.27967e-10 ] ] "source-value" [ [ -0.159411 -0.0874723 -0.00774134 ] [ 1.28203 1.40365 1.4018 ] [ -0.0744566 2.77196 2.86869 ] [ 1.41795 4.01233 4.00515 ] [ 2.72183 0.105785 2.67146 ] [ 4.038 1.47487 4.29534 ] [ 2.69485 2.74872 0.0100738 ] [ 4.0446 4.15007 1.27967 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.696002406304094e-18 "source-value" -35.551651 } }