{ "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" [ 5.37283 0 0 ] "si-unit" "m" "si-value" [ 5.372830000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.256601 5.36059 0 ] "si-unit" "m" "si-value" [ -2.56601e-11 5.36059e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0433697 -0.246629 5.47376 ] "si-unit" "m" "si-value" [ 4.33697e-12 -2.46629e-11 5.473760000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00270324 -0.00280673 0.144383 ] [ 1.34461 1.35881 1.37149 ] [ -0.0221547 2.59799 2.84643 ] [ 1.34697 4.04373 4.10747 ] [ 2.75027 0.00909757 2.6523 ] [ 4.11164 1.31842 4.20835 ] [ 2.66226 2.78619 -0.017694 ] [ 3.99298 4.09333 1.38778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70324e-13 -2.80673e-13 1.44383e-11 ] [ 1.34461e-10 1.35881e-10 1.37149e-10 ] [ -2.21547e-12 2.59799e-10 2.84643e-10 ] [ 1.34697e-10 4.04373e-10 4.10747e-10 ] [ 2.75027e-10 9.09757e-13 2.6523e-10 ] [ 4.11164e-10 1.31842e-10 4.20835e-10 ] [ 2.66226e-10 2.78619e-10 -1.7694e-12 ] [ 3.99298e-10 4.09333e-10 1.38778e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.6965137 9.0095117 -11.7055412 ] [ 0.9658023 1.6752337 0.8775309 ] [ 1.5320747 4.2960316 -4.2771458 ] [ -2.1641104 -2.9045792 3.4191663 ] [ 3.1881172 2.3265608 0.2247204 ] [ -0.1441585 -7.3125283 0.1003348 ] [ -3.1989435 2.8239483 2.1488856 ] [ -6.8752956 -9.9141786 9.2120491 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.072899777940088e-08 1.443482912948961e-08 -1.875434459896432e-08 ] [ 1.547385878123458e-09 2.684020290629366e-09 1.40595950359299e-09 ] [ 2.454654285882559e-09 6.883001448445634e-09 -6.852743060971237e-09 ] [ -3.467287116276393e-09 -4.653648925842412e-09 5.478108353620235e-09 ] [ 5.107926884293504e-09 3.727561351340347e-09 3.600417740631336e-10 ] [ -2.30967380292489e-10 -1.171596197772374e-08 1.607540721370632e-10 ] [ -5.125272529186178e-09 4.524463981884022e-09 3.44289429745907e-09 ] [ -1.101543796216301e-08 -1.588426529822283e-08 1.475932981928073e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -34.192921 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.478309907440791e-18 } }