{ "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" [ [ 1.509479 2.126659 -2.9780982 ] [ 0.2709847 0.3863708 0.4030916 ] [ 0.4825502 1.2307257 -1.0807447 ] [ -0.6869424 -1.1058593 0.8917229 ] [ 0.9216987 0.4760149 0.5319182 ] [ -0.2961192 -1.7570798 -0.2571949 ] [ -0.6693851 0.8569574 0.5056471 ] [ -1.5322659 -2.2137886 1.9836581 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.418451983313686e-09 3.407283358285806e-09 -4.771439349797459e-09 ] [ 4.341653545114998e-10 6.190342678198872e-10 6.458239428816744e-10 ] [ 7.731306551720267e-10 1.971839959403294e-09 -1.73154390565934e-09 ] [ -1.100603062183881e-09 -1.771781930951596e-09 1.428697594382719e-09 ] [ 1.476724120728176e-09 7.626599502158465e-10 8.522269112393387e-10 ] [ -4.744352631187728e-10 -2.815152199633393e-09 -4.120716591639665e-10 ] [ -1.072473166367753e-09 1.372997122613391e-09 8.101359686698613e-10 ] [ -2.454960622054981e-09 -3.546880367535572e-09 3.178170657664835e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.178783 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.796480076915642e-18 } }