PowderCell for Windows: A Free and Easy-to-Use Program for Powder Pattern Calculation and Refinement
Powdercell Download Windows 10: A Guide for Crystallographers
If you are interested in crystal structure analysis and powder diffraction simulation, you may have heard of PowderCell, a free and powerful program that can help you with these tasks. But how can you download and install PowderCell for Windows 10? And what are the main features and functions of this program? In this article, we will answer these questions and provide you with some tips and tricks on how to use PowderCell effectively.
Powdercell download windows 10
What is PowderCell?
PowderCell is a program that calculates powder patterns from single crystal data and refines experimental curves. It was developed by W. Kraus and G. Nolze at the Federal Institute for Materials Research and Testing in Berlin, Germany. The program was first released in 1996 and has been updated several times since then. The latest version is PowderCell 2.4, which was released in 2023.
PowderCell allows you to display crystal structures using more than 740 different settings of space-group types, transform different settings for monoclinic, orthorhombic and rhombohedral space-group types into another, generate subgroups for investigating phase transitions or symmetry effects, vary the structure arrangement within the unit cell using rotation and translation of atoms or molecules, display the corresponding X-ray or neutron powder diffraction patterns simultaneously for up to 10 phases, simulate different diffraction conditions, such as radiation, doublet splitting, diffraction geometry, variable slits, preferred orientation, anomalous dispersion, any volume or mass fractions in a phase mixture etc., select different convolution functions, compare experimental and calculated diffractograms graphically and/or using R-values, export the crystal structure and the simulated powder pattern in different graphic formats, such as Windows Metafile, PostScript, POVRay, use the clipboard to paste graphics and reflection tables into other Windows programs, export the diffraction patterns in different file formats, such as Siemens Diffrac AT: *.raw.
PowderCell also offers some advanced features, such as Le Bail extraction and size/strain analysis, extended overview of all generated atomic positions, bonding angles and distances, space-group information (general and special positions, Wyckoff symbols), structure factor calculation (including magnetic structures), Fourier synthesis (including difference maps), peak search (including indexing), profile fitting (including background subtraction), Rietveld refinement (including constraints and restraints), Monte Carlo simulation (including global optimization).