m_chemistry Module Reference

Multi-species chemistry interface for thermodynamic properties, reaction rates, and transport coefficients. More...

Functions/Subroutines
subroutine	compute_viscosity_and_inversion (t_l, ys_l, t_r, ys_r, re_l, re_r)
	Computes mixture viscosities for left and right states and inverts them for use as reciprocal Reynolds numbers.
subroutine	s_compute_q_t_sf (q_t_sf, q_cons_vf, bounds)
	Initializes the temperature field from conservative variables by inverting the energy equation.
subroutine	s_compute_t_from_primitives (q_t_sf, q_prim_vf, bounds)
	Computes the temperature field from primitive variables using the ideal gas law and mixture molecular weight.
subroutine	s_compute_chemistry_reaction_flux (rhs_vf, q_cons_qp, q_t_sf, q_prim_qp, bounds)
	Adds chemical reaction source terms to the species transport RHS using net production rates.
subroutine	s_compute_chemistry_diffusion_flux (idir, q_prim_qp, flux_src_vf, irx, iry, irz)
	Computes species mass diffusion fluxes at cell interfaces using mixture-averaged diffusivities.

Variables
type(int_bounds_info)	isc1
type(int_bounds_info)	isc2
type(int_bounds_info)	isc3
integer, dimension(3)	offsets

Detailed Description

Multi-species chemistry interface for thermodynamic properties, reaction rates, and transport coefficients.

Function/Subroutine Documentation

compute_viscosity_and_inversion()

subroutine m_chemistry::compute_viscosity_and_inversion	(	real(wp), intent(inout)	t_l,
		real(wp), dimension(num_species), intent(inout)	ys_l,
		real(wp), intent(inout)	t_r,
		real(wp), dimension(num_species), intent(inout)	ys_r,
		real(wp), intent(inout)	re_l,
		real(wp), intent(inout)	re_r )

Computes mixture viscosities for left and right states and inverts them for use as reciprocal Reynolds numbers.

Definition at line 349 of file m_chemistry.fpp.f90.

s_compute_chemistry_diffusion_flux()

subroutine m_chemistry::s_compute_chemistry_diffusion_flux	(	integer, intent(in)	idir,
		type(scalar_field), dimension(sys_size), intent(in)	q_prim_qp,
		type(scalar_field), dimension(sys_size), intent(inout)	flux_src_vf,
		type(int_bounds_info), intent(in)	irx,
		type(int_bounds_info), intent(in)	iry,
		type(int_bounds_info), intent(in)	irz )

Computes species mass diffusion fluxes at cell interfaces using mixture-averaged diffusivities.

Definition at line 574 of file m_chemistry.fpp.f90.

s_compute_chemistry_reaction_flux()

subroutine m_chemistry::s_compute_chemistry_reaction_flux	(	type(scalar_field), dimension(sys_size), intent(inout)	rhs_vf,
		type(scalar_field), dimension(sys_size), intent(inout)	q_cons_qp,
		type(scalar_field), intent(inout)	q_t_sf,
		type(scalar_field), dimension(sys_size), intent(inout)	q_prim_qp,
		type(int_bounds_info), dimension(1:3), intent(in)	bounds )

Adds chemical reaction source terms to the species transport RHS using net production rates.

Definition at line 468 of file m_chemistry.fpp.f90.

s_compute_q_t_sf()

subroutine m_chemistry::s_compute_q_t_sf	(	type(scalar_field), intent(inout)	q_t_sf,
		type(scalar_field), dimension(sys_size), intent(in)	q_cons_vf,
		type(int_bounds_info), dimension(1:3), intent(in)	bounds )

Initializes the temperature field from conservative variables by inverting the energy equation.

Definition at line 399 of file m_chemistry.fpp.f90.

s_compute_t_from_primitives()

subroutine m_chemistry::s_compute_t_from_primitives	(	type(scalar_field), intent(inout)	q_t_sf,
		type(scalar_field), dimension(sys_size), intent(in)	q_prim_vf,
		type(int_bounds_info), dimension(1:3), intent(in)	bounds )

Computes the temperature field from primitive variables using the ideal gas law and mixture molecular weight.

Definition at line 442 of file m_chemistry.fpp.f90.

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Variable Documentation

isc1

type(int_bounds_info) m_chemistry::isc1

Definition at line 321 of file m_chemistry.fpp.f90.

isc2

type(int_bounds_info) m_chemistry::isc2

Definition at line 321 of file m_chemistry.fpp.f90.

isc3

type(int_bounds_info) m_chemistry::isc3

Definition at line 321 of file m_chemistry.fpp.f90.

offsets

integer, dimension(3) m_chemistry::offsets

Definition at line 333 of file m_chemistry.fpp.f90.