{ "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" [ 5.50751 0 0 ] "si-unit" "m" "si-value" [ 5.50751e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0552432 5.46365 0 ] "si-unit" "m" "si-value" [ 5.52432e-12 5.46365e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.041151 -0.173599 5.4807 ] "si-unit" "m" "si-value" [ -4.115100000000001e-12 -1.73599e-11 5.4807e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0203681 -0.0104771 -0.043973 ] [ 1.36957 1.30557 1.36025 ] [ 0.0138031 2.57027 2.84477 ] [ 1.29725 4.08516 4.13225 ] [ 2.77149 -0.00701058 2.61036 ] [ 3.98017 1.30013 4.07827 ] [ 2.6961 2.74296 0.249943 ] [ 4.17055 4.00651 1.44609 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03681e-12 -1.04771e-12 -4.3973e-12 ] [ 1.36957e-10 1.30557e-10 1.36025e-10 ] [ 1.38031e-12 2.57027e-10 2.84477e-10 ] [ 1.29725e-10 4.08516e-10 4.13225e-10 ] [ 2.77149e-10 -7.01058e-13 2.61036e-10 ] [ 3.98017e-10 1.30013e-10 4.07827e-10 ] [ 2.6961e-10 2.74296e-10 2.49943e-11 ] [ 4.170550000000001e-10 4.00651e-10 1.44609e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9097207 1.5052203 1.4898415 ] [ -0.9255103 -0.1872483 0.724592 ] [ -0.5388141 1.0153575 -0.7293805 ] [ 2.9459287 -2.1864618 -1.1450491 ] [ -1.3849181 -1.04434 1.9721721 ] [ 1.1596628 -0.3504051 1.6554626 ] [ 0.1624572 0.7722007 -3.6127401 ] [ 1.4909143 0.4756768 -0.3548986 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.661886517006124e-09 2.41162879368247e-09 2.386989239663511e-09 ] [ -1.48283097718633e-09 -3.000048510162221e-10 1.160924371583328e-09 ] [ -8.632753610897393e-10 1.626782061656655e-09 -1.168596394395237e-09 ] [ 4.719898128569995e-09 -3.503098007093581e-09 -1.834570912802729e-09 ] [ -2.218883419823675e-09 -1.67321714595156e-09 3.159768056846711e-09 ] [ 1.857984641479015e-09 -5.614108636544333e-10 2.652343496180888e-09 ] [ 2.602851298650648e-10 1.237201918298443e-09 -5.788247772934823e-09 ] [ 2.388708054756466e-09 7.621182542958911e-10 -5.686102443593123e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.641141 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.710340331929938e-18 } }