{ "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" [ 5.5048 0 0 ] "si-unit" "m" "si-value" [ 5.5048e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0192448 5.36034 0 ] "si-unit" "m" "si-value" [ 1.92448e-12 5.36034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.190348 0.0157222 5.58687 ] "si-unit" "m" "si-value" [ 1.90348e-11 1.57222e-12 5.58687e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0113409 -0.0687251 -0.0764128 ] [ 1.39555 1.34846 1.39039 ] [ 0.152538 2.8802 2.74744 ] [ 1.52254 4.15487 3.86439 ] [ 2.76536 0.0171046 2.52424 ] [ 4.13989 1.28016 4.0502 ] [ 2.78466 2.66896 -0.17742 ] [ 4.2307 4.05829 1.13615 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.13409e-12 -6.87251e-12 -7.641280000000001e-12 ] [ 1.39555e-10 1.34846e-10 1.39039e-10 ] [ 1.52538e-11 2.8802e-10 2.74744e-10 ] [ 1.52254e-10 4.15487e-10 3.864390000000001e-10 ] [ 2.76536e-10 1.71046e-12 2.52424e-10 ] [ 4.13989e-10 1.28016e-10 4.0502e-10 ] [ 2.78466e-10 2.66896e-10 -1.7742e-11 ] [ 4.2307e-10 4.058290000000001e-10 1.13615e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.480022 2.746557 -2.1806462 ] [ -0.8814929 1.1627911 -2.2271437 ] [ -2.3950099 -2.523147 -1.7437197 ] [ 0.7295364 -0.6756758 3.6799691 ] [ 2.3879894 0.2628091 0.4022575 ] [ 1.8503912 -0.0073282 -0.7232297 ] [ -1.429921 0.9206715 0.4965755 ] [ -1.7415152 -1.8866778 2.2959372 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.371256646669658e-09 4.400469413094586e-09 -3.493780359876361e-09 ] [ -1.412307315781192e-09 1.862996715294315e-09 -3.568277567302009e-09 ] [ -3.837228868364545e-09 -4.042527134241658e-09 -2.79374693656839e-09 ] [ 1.168846164102597e-09 -1.082551970000337e-09 5.895960457286418e-09 ] [ 3.82598078739822e-09 4.210665957534893e-10 6.44487562041456e-10 ] [ 2.964653519974057e-09 -1.174107071254656e-11 -1.158741716808198e-09 ] [ -2.290985995790957e-09 1.475078352736867e-09 7.956016565620704e-10 ] [ -2.790214938207836e-09 -3.022791062142378e-09 3.678496904665014e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.418477 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.674665579374253e-18 } }