{ "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" [ 5.23298 0 0 ] "si-unit" "m" "si-value" [ 5.23298e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.924429 5.53043 0 ] "si-unit" "m" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.629107 -0.473789 5.46851 ] "si-unit" "m" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1053416 0.524853 -0.0288444 ] [ -7.9058789 -4.6410946 2.8216112 ] [ 1.0426438 -0.896312 -2.0018261 ] [ 0.5959552 2.389616 1.8982691 ] [ 1.2258278 -2.0993373 4.0203727 ] [ -0.6423266 -1.5893815 1.4801185 ] [ 3.0594952 3.2235371 -7.3938286 ] [ 1.5189418 3.0881193 -0.7958724 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.770952469517665e-09 8.409072059567424e-10 -4.621382332100353e-11 ] [ -1.266661434045602e-08 -7.435853263041128e-09 4.520719497627433e-09 ] [ 1.670499520182071e-09 -1.43605013134249e-09 -3.207278976327243e-09 ] [ 9.548254884841883e-10 3.828586887889613e-09 3.041362372007058e-09 ] [ 1.963992642286698e-09 -3.363509141233396e-09 6.441347146842572e-09 ] [ -1.029120661437953e-09 -2.546469880832035e-09 2.371411256713565e-09 ] [ 4.901851680889821e-09 5.164675777901433e-09 -1.184621932112239e-08 ] [ 2.433613040315869e-09 4.947712544701261e-09 -1.275128152419986e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.087548 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.53881530163978e-18 } }