-
- ABSMSF
- To read ARRNGE files, apply absorption corrections and calculate mean structure factors
- ADDFC
- Adds calculated structure factors to a list of hkl and observed F's
- ARRINC
- To group together equivalent reflections for structures with non-zero propagation vectors
- ARRNGE
- To group together equivalent reflections and give some statistics on their degree of equivalence, indices may be submultiples of integers.
- AVEXAR
- To read ARRNGE files and prepare for LSQ with extinction
-
- BONDS
- Calculation of bond lengths and angles. Can also write cards for geometric slack constraints
-
- CALMSF
- To calculate the magnetic structure factors for a given list of indices.
- CALQSF
- To calculate the magnetic interaction vectors for each domain for a given list of indices. The results are given on polarisation axes.
- CHILSQ
- Least squares refinement from magnetic structure factor data (paramagnetic version)
-
- D3OP99
- Analysis of raw D3 data 1999 version
-
- EXTCAL
- Calculates extinction coefficients and writes a data file for least squares
-
- FORFAC
- Calculates form factors and radial electron densities from Slater type radial wave-functions
- FORFIG
- General fourier inversion program showing atom positions
- FOURPL
- General fourier inversion program
-
- GENREF
- To generate reflections and create a D3 measuring file
- GETMSF
- To generate magnetic and fundamental reflection indices and calculate the corresponding stucture factors.
- GETSFZ
- To generate reflection indices and calculate the corresponding stucture factors.
- GRAFIC
-
- INCMSF
- To calculate the mean structure factors of satellite reflections from data arranged by ARRINC
-
- MADUBM
- To generate D cards for the UB matrix read from a record stored on the ILL data base
- MAG3D
- To draw magnetic structures in 3D
- MAGLSQ
- Least squares refinement from magnetic structure factor data
- MAGPOW
- To generate indices of reflections in a magnetic powder diagram
- MEANWT
- Interactive calculation of weighted means
- MG3DGL
- Prepares the data for an animated 3d display of a magnetic structure
- MMPLSQ
- Magnetic least squares with multipole description of form factors
- MPLSQ
- Structure factor least squares using multipole form factors
- MVENTR
- To draw magnetic structures in 3D in SGI inventor format
-
- PALSQ
- Least squares refinement from neutron polarimetry data
- POWDER
- To calculate the positions and intensities of the lines in a powder diagram
-
- SFLSQ
- Least squares refinement from measured structure factors
- SFTLSQ
- Least squares refinement from structure factors measured on twinned crystals
- SORGAM
- Calculation of gamma and magnetic structure factors from flipping ratios
P. Jane Brown
e-mail: brown@ill.fr
Institut Laue Langevin,
Grenoble, FRANCE