{ "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" [ 5.5417 0 0 ] "si-unit" "m" "si-value" [ 5.5417e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0877832 5.55439 0 ] "si-unit" "m" "si-value" [ -8.77832e-12 5.55439e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0308884 0.040745 5.63916 ] "si-unit" "m" "si-value" [ 3.08884e-12 4.074500000000001e-12 5.63916e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.6509955 1.0378447 -0.3951841 ] [ 9.4064595 0.7952431 6.5639032 ] [ 3.0382066 -4.7089528 4.9362001 ] [ 1.1132712 -2.6435544 -3.0806301 ] [ -10.7243547 3.1582048 -4.4348025 ] [ 1.9510399 7.6794747 3.2514438 ] [ 3.881317 -2.1959326 0.365907 ] [ -4.0149439 -3.1223274 -7.2068375 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.451716253546007e-09 1.66281051436119e-09 -6.331547259318894e-10 ] [ 1.507080949540206e-08 1.274119902672516e-09 1.051653224823431e-08 ] [ 4.867743583680257e-09 -7.544574084610697e-09 7.908664395810622e-09 ] [ 1.783657089249961e-09 -4.235441055492972e-09 -4.935713523552766e-09 ] [ -1.71823103735066e-08 5.060001894258339e-09 -7.105336883365393e-09 ] [ 3.12591051402797e-09 1.230387482436509e-08 5.209387240205111e-09 ] [ 6.218555355313594e-09 -3.518271872572558e-09 5.862476407870656e-10 ] [ -6.432649250403573e-09 -5.002519962763251e-09 -1.154662655240472e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -12.503654 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.00330621133724e-18 } }