{ "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" [ [ 4.14889724227319e-10 9.809062001705567e-10 -3.43071996982297e-09 ] [ 7.517814851125421e-10 1.703374902699591e-09 6.234982472206656e-11 ] [ -1.579441734550848e-11 8.168325796172775e-10 -8.568877962255879e-10 ] [ 4.725623147402842e-10 1.750961150513972e-10 8.607110702958028e-10 ] [ 3.552491801710253e-10 8.057903783467239e-10 -6.003243645774144e-11 ] [ 6.487938923628423e-10 -2.061134212982423e-09 3.107266144909383e-10 ] [ -2.244117362885032e-09 4.017965766644794e-10 -1.163982917187821e-10 ] [ -3.83364816383472e-10 -2.822662539567602e-09 3.230251144933935e-09 ] ] "source-value" [ [ 0.2589538 0.6122335 -2.141287 ] [ 0.4692251 1.063163 0.0389157 ] [ -0.0098581 0.5098268 -0.5348273 ] [ 0.2949502 0.1092864 0.5372136 ] [ 0.2217291 0.5029348 -0.0374693 ] [ 0.4049453 -1.2864588 0.1939403 ] [ -1.4006679 0.2507817 -0.0726501 ] [ -0.2392775 -1.7617674 2.0161642 ] ] } "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" 2.503767708228501e-17 "source-value" 156.27289 } }