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(*
Copyright (C) 2017 M.A.L. Marques
This Source Code Form is subject to the terms of the Mozilla Public
License, v. 2.0. If a copy of the MPL was not distributed with this
file, You can obtain one at http://mozilla.org/MPL/2.0/.
*)
(* type: work_mgga_c *)
par_n := 6:
gamma_x := 0.004:
par_x := [
[ 0.85, 0, 0],
[ 1.007, 0, 1],
[ 0.259, 1, 0],
[ 0, 0, 0],
[ 0, 0, 0],
[ 0, 0, 0]
]:
gamma_ss := 0.2:
par_ss := [
[ 0.443, 0, 0],
[ -1.437, 0, 4],
[ -4.535, 1, 0],
[ -3.39, 2, 0],
[ 4.278, 4, 3],
[ 0, 0, 0]
]:
gamma_os := 0.006:
par_os := [
[ 1.000, 0, 0],
[ 1.358, 1, 0],
[ 2.924, 2, 0],
[ -8.812, 2, 1],
[ -1.39, 6, 0],
[ 9.142, 6, 1]
]:
$include "lda_x_erf.mpl"
$include "b97mv.mpl"
f := (rs, z, xt, xs0, xs1, ts0, ts1, us0, us1) ->
f_b97mv(f_lda_x_erf, rs, z, xt, xs0, xs1, ts0, ts1):
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