{ "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" [ 5.47225 0 0 ] "si-unit" "m" "si-value" [ 5.47225e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0720088 5.55574 0 ] "si-unit" "m" "si-value" [ -7.20088e-12 5.55574e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0610026 -0.0268755 5.37267 ] "si-unit" "m" "si-value" [ -6.10026e-12 -2.68755e-12 5.37267e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0205094 -0.0758047 0.142316 ] [ 1.30951 1.38319 1.48801 ] [ -0.0602099 2.69484 2.70363 ] [ 1.30902 4.05591 4.11478 ] [ 2.76224 0.0853385 2.86654 ] [ 4.01949 1.17816 4.04456 ] [ 2.72232 2.71295 0.0698342 ] [ 4.15368 4.12703 1.42088 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.05094e-12 -7.580470000000001e-12 1.42316e-11 ] [ 1.30951e-10 1.38319e-10 1.48801e-10 ] [ -6.02099e-12 2.69484e-10 2.70363e-10 ] [ 1.30902e-10 4.05591e-10 4.11478e-10 ] [ 2.76224e-10 8.53385e-12 2.86654e-10 ] [ 4.01949e-10 1.17816e-10 4.04456e-10 ] [ 2.72232e-10 2.71295e-10 6.983420000000001e-12 ] [ 4.15368e-10 4.127030000000001e-10 1.42088e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6371440000000002 0.12879620000000003 -1.1840750000000002 ] [ 0.9944724000000003 -0.37954710000000014 -0.7667099000000003 ] [ -0.29167870000000007 -0.054078500000000015 1.3770636000000003 ] [ -0.16939350000000003 0.8480882000000002 0.011828800000000004 ] [ -1.5704084000000005 -3.3592085000000007 -2.5064200000000003 ] [ 1.9488579000000004 2.9314799000000002 2.3006439000000003 ] [ 0.5019250000000001 -0.38818950000000013 0.09854880000000003 ] [ -2.0509187000000004 0.27265930000000005 0.6691199000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.020817229293296e-09 2.063542621879908e-10 -1.89709729790355e-09 ] [ 1.593320442437902e-09 -6.081014951224616e-10 -1.228404686836477e-09 ] [ -4.673207977754958e-10 -8.664330910176903e-11 2.206299123451923e-09 ] [ -2.71398307651479e-10 1.358787097611119e-09 1.89518269682592e-11 ] [ -2.516071644317326e-09 -5.38204536743419e-09 -4.015727558990281e-09 ] [ 3.122414590366309e-09 4.696748598820657e-09 3.686037899734633e-09 ] [ 8.0417250702045e-10 -6.219481464641431e-10 1.578925846687392e-10 ] [ -3.285934019373656e-09 4.368483595027962e-10 1.072048269124417e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.63334529230348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.548873658458253e-18 } }