{ "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" [ 5.42802 0 0 ] "si-unit" "m" "si-value" [ 5.42802e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0476613 5.42825 0 ] "si-unit" "m" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0987222 -0.186163 5.49756 ] "si-unit" "m" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.9331542999999995 2.9346912999999994 -1.6200287999999996 ] [ 0.9974085999999998 -1.1102861999999998 -1.5046859999999995 ] [ -1.3431987999999997 2.5138767999999994 0.7105824999999999 ] [ -0.3937097999999999 -1.2306568999999998 0.40148299999999987 ] [ -0.5312209999999999 -0.14097019999999996 -0.27699999999999997 ] [ 1.4189769999999997 -1.2869526999999998 0.3780836999999999 ] [ -2.9886981999999995 -0.6859062999999999 -1.4372753999999999 ] [ 0.9072880999999998 -0.9937957999999998 3.348841099999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.097254623858989e-09 4.701893790125158e-09 -2.595572268382678e-09 ] [ 1.598024740304859e-09 -1.778874592036873e-09 -2.410772730845068e-09 ] [ -2.152041714446615e-09 4.027674636531516e-09 1.138478668649616e-09 ] [ -6.307926369398437e-10 -1.971729713406204e-09 6.432466762486462e-10 ] [ -8.511098666779968e-10 -2.258591586695001e-10 -4.438029239616e-10 ] [ 2.273451774852921e-09 -2.061925528015436e-09 6.057568648455608e-10 ] [ -4.788422382667042e-09 -1.098943037919431e-09 -2.302769043530968e-09 ] [ 1.453635782150052e-09 -1.592236396609232e-09 5.365434917194154e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.009692 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.76938866446088e-18 } }