pwdft
0.1
PW-DFT code for education
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Variables | |
real(8), parameter | pi = acos(-1.0d0) |
real(8), parameter | bohr2ang = 0.529177249d0 |
real(8), parameter | htr2ev = 27.21138456d0 |
real(8), parameter constant::pi = acos(-1.0d0) |
Definition at line 25 of file constant.F90.
Referenced by energy::ewald(), rho_v::generate_vps(), energy::hartree(), rho_v::hartree_pot(), griddata::read_griddata(), stdin::read_stdin(), gvec::setup_gvec(), energy::xc(), and rho_v::xc_pot().
real(8), parameter constant::bohr2ang = 0.529177249d0 |
Definition at line 26 of file constant.F90.
Referenced by stdin::read_stdin(), and griddata::write_griddata().
real(8), parameter constant::htr2ev = 27.21138456d0 |
Definition at line 27 of file constant.F90.
Referenced by energy::atomic(), plot::band_plot(), energy::ewald(), plot::fermi_plot(), energy::hartree(), energy::kinetic(), k_point::ksum_dos(), pwdft(), stdin::read_stdin(), scf::scf_loop(), energy::total_e(), and energy::xc().