{ "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" [ 5.49393 0 0 ] "si-unit" "m" "si-value" [ 5.49393e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.002595 5.45604 0 ] "si-unit" "m" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698117 0.0748179 5.57684 ] "si-unit" "m" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0568347 0.000259582 0.0366732 ] [ 1.4042 1.34788 1.25876 ] [ -0.0116956 2.70772 2.89683 ] [ 1.4664 4.01047 4.21293 ] [ 2.72042 0.0465962 2.58375 ] [ 4.04434 1.40284 4.02526 ] [ 2.59741 2.72967 0.138309 ] [ 4.11134 4.10597 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.683470000000001e-12 2.59582e-14 3.66732e-12 ] [ 1.4042e-10 1.34788e-10 1.25876e-10 ] [ -1.16956e-12 2.70772e-10 2.89683e-10 ] [ 1.4664e-10 4.01047e-10 4.21293e-10 ] [ 2.72042e-10 4.65962e-12 2.583750000000001e-10 ] [ 4.04434e-10 1.40284e-10 4.02526e-10 ] [ 2.59741e-10 2.72967e-10 1.38309e-11 ] [ 4.11134e-10 4.10597e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0358458 -0.7632311 -2.219294 ] [ -2.4704217 0.0717347 2.2156381 ] [ 0.9018816 0.2836874 -2.2686134 ] [ -2.1130115 2.6753429 -0.678361 ] [ 0.1187636 -0.999561 1.8886649 ] [ -1.2532499 0.0597881 2.5619771 ] [ 3.615438 -0.5307182 -2.1742315 ] [ 0.164754 -0.7970428 0.6742198 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.659607937187037e-09 -1.222831034762118e-09 -3.555700990776396e-09 ] [ -3.958051923866558e-09 1.149316601869998e-10 3.549843593220155e-09 ] [ 1.444973626154534e-09 4.545173236402115e-10 -3.634719381059295e-09 ] [ -3.385417652673291e-09 4.286371882317798e-09 -1.086854143616874e-09 ] [ 1.902802648897224e-10 -1.601473278457674e-09 3.025974772235946e-09 ] [ -2.007927706342836e-09 9.579109681125538e-11 4.104739846463081e-09 ] [ 5.792570285275692e-09 -8.503042992785388e-10 -3.48350290620677e-09 ] [ 2.63965009158036e-10 -1.277003350457935e-09 1.080219209740153e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.82705429230348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.419691598417804e-18 } }