{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.372830000000001e-10 0.0 0.0 ] "source-value" [ 5.37283 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.56601e-11 5.36059e-10 0.0 ] "source-value" [ -0.256601 5.36059 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 4.33697e-12 -2.46629e-11 5.473760000000001e-10 ] "source-value" [ 0.0433697 -0.246629 5.47376 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.257960621645153e-08 5.053017205279963e-09 -2.664769956199707e-09 ] [ 9.615994912369306e-10 7.9500003924096e-11 3.070839217476536e-09 ] [ 1.117359257087217e-08 -2.044012071871258e-09 3.8036103963303e-09 ] [ -2.84995722047955e-09 -1.680574166991323e-09 -6.435425502052095e-09 ] [ -4.670415185185653e-09 -4.859656597186769e-09 -2.556755374084585e-09 ] [ -1.726978969765526e-09 5.359835950775107e-09 -2.324027363806391e-09 ] [ 4.556023139031437e-10 1.360215907526784e-11 5.291328961299306e-09 ] [ -1.592304905681538e-08 -1.921712643222745e-09 1.815199621036637e-09 ] ] "source-value" [ [ 7.8515727 3.1538453 -1.6632186 ] [ 0.6001832 0.049619999999999984 1.9166671 ] [ 6.974008 -1.275772 2.3740269 ] [ -1.7788034 -1.0489319 -4.0166767 ] [ -2.9150439 -3.0331591 -1.5958012 ] [ -1.0778955 3.3453465 -1.4505438 ] [ 0.2843646 0.008489799999999981 3.3025878 ] [ -9.9383856 -1.1994387 1.1329585 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.781921591365589e-18 "source-value" -17.363389 } }