{ "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" [ 5.42446 0 0 ] "si-unit" "m" "si-value" [ 5.42446e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00225581 5.46076 0 ] "si-unit" "m" "si-value" [ -2.25581e-13 5.46076e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0117255 0.0343157 5.56103 ] "si-unit" "m" "si-value" [ -1.17255e-12 3.43157e-12 5.56103e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3958281 -0.1230883 0.3542275 ] [ 0.0282785 0.99444 -2.1463661 ] [ -1.6349583 0.5770442 0.198607 ] [ 3.7386479 1.0908988 -0.1830881 ] [ -0.6218111 -3.2072915 2.3357127 ] [ -0.3226434 1.1700307 1.6764298 ] [ -0.6150801 -0.5384818 -1.9515708 ] [ 0.8233945 0.0364478 -0.2839521 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.236363148475684e-09 -1.972091965540166e-10 5.67535018944432e-10 ] [ 4.530715157129281e-11 1.593268518788352e-09 -3.438857585097674e-09 ] [ -2.619491964242913e-09 9.245267264082393e-10 3.182034921272256e-10 ] [ 5.989974258783016e-09 1.747812553018775e-09 -2.933394733666925e-10 ] [ -9.962512069739307e-10 -5.138647457390564e-09 3.742224280845644e-09 ] [ -5.169317123354228e-10 1.874595833158259e-09 2.68593663197242e-09 ] [ -9.854669561393262e-10 -8.627429506863015e-10 -3.126761109595953e-09 ] [ 1.319223417595306e-09 5.839581303959425e-11 -4.549414160470637e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.199715 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.799833705262307e-18 } }