{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.42446e-10 0.0 0.0 ] "source-value" [ 5.42446 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.25581e-13 5.46076e-10 0.0 ] "source-value" [ -0.00225581 5.46076 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.17255e-12 3.43157e-12 5.56103e-10 ] "source-value" [ -0.0117255 0.0343157 5.56103 ] } "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" [ [ 2.637655199722274e-09 -4.277097006763123e-09 -4.788800015696565e-09 ] [ -7.138487359608703e-09 5.927908980628803e-09 -9.660545195704931e-09 ] [ -1.256064814115059e-10 6.082504925381741e-10 6.340384545123901e-09 ] [ -1.583627485059753e-08 3.116104552238025e-09 3.611687901971937e-09 ] [ 1.871067968413387e-08 -8.274875347985838e-10 2.384584513107444e-09 ] [ 5.479379475418182e-09 -7.648849987581183e-09 -9.303493887270831e-09 ] [ 4.238721351906398e-09 6.353720102009469e-09 1.717849078444261e-08 ] [ -7.966067019562982e-09 -3.252549598271582e-09 -5.762308485755902e-09 ] ] "source-value" [ [ 1.6462949 -2.669554 -2.9889339 ] [ -4.4554934 3.6999098 -6.0296381 ] [ -0.0783974 0.3796401 3.9573568 ] [ -9.8842254 1.9449195 2.2542383 ] [ 11.6782878 -0.5164771 1.4883406 ] [ 3.4199597 -4.7740367 -5.8067842 ] [ 2.6456018 3.9656802 10.7219707 ] [ -4.972028 -2.0300818 -3.5965501 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.82071e-12 1.39191e-13 1.64222e-12 ] [ 1.32892e-10 1.32964e-10 1.49498e-10 ] [ -5.098020000000001e-13 2.67752e-10 2.7579e-10 ] [ 1.15566e-10 4.0451e-10 4.18086e-10 ] [ 2.64397e-10 1.06198e-11 2.73506e-10 ] [ 4.036990000000001e-10 1.34406e-10 4.11378e-10 ] [ 2.695e-10 2.72586e-10 1.09097e-11 ] [ 4.009330000000001e-10 4.13019e-10 1.43696e-10 ] ] "source-value" [ [ 0.0182071 0.00139191 0.0164222 ] [ 1.32892 1.32964 1.49498 ] [ -0.00509802 2.67752 2.7579 ] [ 1.15566 4.0451 4.18086 ] [ 2.64397 0.106198 2.73506 ] [ 4.03699 1.34406 4.11378 ] [ 2.695 2.72586 0.109097 ] [ 4.00933 4.13019 1.43696 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.400372041093484e-18 "source-value" -14.981944 } }