1!
2! Copyright (C) 2001-2020 Quantum ESPRESSO group
3! This file is distributed under the terms of the
4! GNU General Public License. See the file `License'
5! in the root directory of the present distribution,
6! or http://www.gnu.org/copyleft/gpl.txt .
7!
8!
9MODULE parameters
10
11  IMPLICIT NONE
12  SAVE
13
14  INTEGER, PARAMETER :: &
15       npk    = 40000,  &! max number of k-points
16       ntypx  = 10,     &! max number of different types of atom
17       nsx    = ntypx,  &! max number of atomic species (CP)
18       natx   = 50,     &! max number of atoms for DFT+U+V calculations
19       sc_size = 1       ! Defines the supercell in DFT+U+V as composed by the unit cells located
20                         ! by (n1,n2,n3) in primitive vectors base with -sc_size <= ni <= sc_size,
21                         ! (2*sc_size+1)**3 is the number of cells
22
23END MODULE parameters
24