gudasergey / fdmnesLinks
FDMNES
☆10Updated 4 years ago
Alternatives and similar repositories for fdmnes
Users that are interested in fdmnes are comparing it to the libraries listed below
Sorting:
- python wrapper for fdmnes data input/output☆13Updated 4 years ago
- Core-Level Spectroscopy Simulations in Python☆42Updated 6 months ago
- Python implementation of FitIt software to fit X-ray absorption near edge structure (XANES) extended with additional features.☆37Updated 6 months ago
- Process and analyze X-ray Absorption Spectroscopy data using Feff and either Larch or Ifeffit.☆70Updated last month
- Crystal structure container and parsers for structure formats.☆35Updated 3 weeks ago
- Reads crystallographic cif files and simulates diffraction☆66Updated last month
- LiquidDiffract is a GUI program to process experimental X-ray diffraction data of liquids/amorphous solids.☆20Updated 3 weeks ago
- xrayutilities - a package with useful scripts for X-ray diffraction physicists☆90Updated 5 months ago
- Larch: Applications and Python Library for Data Analysis of X-ray Absorption Spectroscopy (XAS, XANES, XAFS, EXAFS), X-ray Fluorescence (…☆152Updated this week
- AiiDA plugin of the high-performance density functional theory code JuKKR (www.judft.de) for high-throughput electronic structure calcula…☆14Updated 2 months ago
- Simulation package for constructing model band structures and calculate momentum resolved EEELS (low loss region) on the basis of these☆15Updated 4 years ago
- ☆27Updated last month
- Thermodynamics of solids in the quasiharmonic approximation.☆38Updated 2 months ago
- ☆20Updated last year
- Python scripts to manage and postprocess quantum espresso and yambo calculation.☆16Updated this week
- ☆58Updated 3 weeks ago
- Generating k-point grids with the best folding ratio or fewest irreducible k-points for a given density☆39Updated 11 months ago
- NIST Interatomic Potential Repository property calculation tools☆24Updated last year
- Python bindings to ObjCryst++ Object-Oriented Crystallographic Library☆17Updated 3 weeks ago
- A physics computational framework for python and ipython☆38Updated last week
- ☆14Updated this week
- A module for ASE for elastic constants calculation.☆46Updated 5 months ago
- MULTEM is a powerful and advanced collection of C++ routines with CUDA support, designed to perform efficient and accurate multislice sim…☆73Updated 2 weeks ago
- A graphical user interface of Python lmfit package was developed for standard X-ray photoemission spectroscopy (XPS) curve fitting analys…☆54Updated last month
- TEM data quantification library through a model-based approach☆19Updated 2 weeks ago
- A Basic Symmetry Module (Python)☆17Updated 3 months ago
- A one-stop-shop for handling data in computational spectroscopy☆16Updated 4 months ago
- A simulation package of phonon-phonon interaction related properties☆140Updated this week
- Python interface for the Dr. Probe command line tools☆12Updated 4 years ago
- Python code for phase identification and spectrum analysis of energy dispersive x-ray spectroscopy (EDS)☆20Updated last year