{ "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" [ [ 4.4636372 6.2134505 -7.614067 ] [ 0.334787 0.7115668 0.8745055 ] [ 1.3646288 3.3444907 -2.7365406 ] [ -1.7982023 -2.7355853 2.1536017 ] [ 2.3984335 1.9032145 0.5657152 ] [ -0.6064233 -5.0444813 -0.1445181 ] [ -1.6867232 2.2173604 1.1625979 ] [ -4.4701377 -6.6100163 5.7387054 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.151535165573174e-09 9.955045125598072e-09 -1.219908013660479e-08 ] [ 5.363879043477696e-10 1.14005569109747e-09 1.401112266861015e-09 ] [ 2.186376359430359e-09 5.358464808023027e-09 -4.384421371190005e-09 ] [ -2.881037684528788e-09 -4.382890811864154e-09 3.450450294255135e-09 ] [ 3.842714080243516e-09 3.049285776267562e-09 9.063756674711961e-10 ] [ -9.715972335683847e-10 -8.082150002922792e-09 -2.315435211024365e-10 ] [ -2.702428476800963e-09 3.552602992767736e-09 1.862687174771176e-09 ] [ -7.161950114696685e-09 -1.059041357896692e-08 9.194419625538711e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.07496 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.619628088749516e-18 } }