The `Powder_process` Component

A sample component implementing a powder scattering process

Identification

Site:
Author: Mads Bertelsen and Erik B Knudsen
Origin: ESS DMSC & DTU Physics & United Neux
Date: 20.08.15

Description

This Union_process is based on the PowerN.comp component.

Part of the Union components, a set of components that work together and thus
separates geometry and physics within McXtrace.
The use of this component requires other components to be used.

1) One specifies a number of processes using process components like this one
2) These are gathered into material definitions using Union_make_material
3) Geometries are placed using Union_box / Union_cylinder, assigned a material
4) A Union_master component placed after all of the above

Only in step 4 will any simulation happen, and per default all geometries
defined before the master, but after the previous will be simulated here.

There is a dedicated manual available for the Union_components

Algorithm:
Described elsewhere

Input parameters

Parameters in boldface are required; the others are optional.

Name	Unit	Description	Default
reflections	string	Input file for reflections. No scattering if NULL or "" [string]	"NULL"
material	str	Reflection list for power	"NULL"
packing_factor	1	How dense is the material compared to optimal 0-1	1
Vc	AA^3	Volume of unit cell=nb atoms per cell/density of atoms.	0
delta_d_d	0/1	Global relative delta_d_d/d broadening when the 'w' column is not available. Use 0 if ideal.	0
DW	1	Global Debye-Waller factor when the 'DW' column is not available. Use 1 if included in F2	0
nb_atoms	1	Number of sub-unit per unit cell, that is ratio of sigma for chemical formula to sigma per unit cell	1
density	g/cm^3	Density of material. rho=density/weight/1e24*N_A.	0
weight	g/mol	Atomic/molecular weight of material.	0
barns	1	Flag to indicate if \|F\|^2 from 'reflections' is in barns or fm^2 (barns=1 for laz, barns=0 for lau type files).	1
Strain	ppm	Global relative delta_d_d/d shift when the 'Strain' column is not available. Use 0 if ideal.	0
interact_fraction	1	How large a part of the scattering events should use this process 0-1 (sum of all processes in material = 1)	-1
format	no quotes	Name of the format, or list of column indexes (see Description).	{0, 0, 0, 0, 0, 0, 0, 0, 0}
mat_format	vector	List order in reflection list file	{0,0,0,0,0}

AT (	,	,		) RELATIVE
ROTATED (	,	,		) RELATIVE

McXtrace - An X-ray ray-trace simulation package

The Powder_process Component

Identification

Description

Input parameters

Links

The `Powder_process` Component