DiffPy-CMI tutorial files for the ADD2019 workshop, ILL, Grenoble
☆12Mar 25, 2019Updated 6 years ago
Alternatives and similar repositories for add2019-diffpy-cmi
Users that are interested in add2019-diffpy-cmi are comparing it to the libraries listed below
Sorting:
- Python bindings to ObjCryst++ Object-Oriented Crystallographic Library☆17Feb 6, 2026Updated 3 weeks ago
- Suite of programs to simulate disordered and nanomaterials☆61Feb 14, 2026Updated last week
- Accelerated molecular crystal structure determination from powder diffraction data☆13Jun 20, 2025Updated 8 months ago
- Scripts for building binary release bundle for Linux and Mac.☆11Feb 12, 2024Updated 2 years ago
- Free Objects for Crystallography : Fox / ObjCryst++☆25Feb 3, 2026Updated 3 weeks ago
- Example scripts for the DiffPy-CMI complex modeling framework☆10Feb 12, 2024Updated 2 years ago
- Python based GUI-Program for integration and exploration of 2D x-ray diffraction images.☆65Updated this week
- Crystal structure container and parsers for structure formats.☆35Updated this week
- Set of scripts for working with Topas☆16Apr 16, 2025Updated 10 months ago
- Diffcalc: a diffraction condition calculator for X-ray or neutron diffractometer control☆22Apr 26, 2023Updated 2 years ago
- Official public repository for the XtalOpt crystallographic multi-objective variable-composition evolutionary algorithm☆50Nov 4, 2025Updated 3 months ago
- Browser plugin-free CIF visualization: comparison of the open-source engines☆22Jul 17, 2020Updated 5 years ago
- xrayutilities - a package with useful scripts for X-ray diffraction physicists☆94Dec 9, 2025Updated 2 months ago
- A code to compute the radial distribution function☆21Feb 22, 2019Updated 7 years ago
- BCDI: tools for pre(post)-processing Bragg coherent X-ray diffraction imaging data☆26Sep 4, 2024Updated last year
- Reads crystallographic cif files and simulates diffraction☆73Sep 15, 2025Updated 5 months ago
- Lennard-Jones Molecular Dynamics for beginners☆15Sep 20, 2021Updated 4 years ago
- This software package simulates the reduction of graphene oxide and calculates the optical response of the generated sp2 domains☆11Dec 22, 2016Updated 9 years ago
- This code deals with MD trajectory from VASP. It calculates lattice parameters, RMSD, and coordination number and also generates .xyz out…☆11Oct 11, 2021Updated 4 years ago
- ☆41Feb 21, 2024Updated 2 years ago
- Larch: Applications and Python Library for Data Analysis of X-ray Absorption Spectroscopy (XAS, XANES, XAFS, EXAFS), X-ray Fluorescence (…☆168Updated this week
- Application for Raman Spectroscopy Analysis☆13Jan 24, 2025Updated last year
- Python3 script to create Voronoi tessellations (mosaic pattern) on images☆10May 25, 2019Updated 6 years ago
- TDL☆11Mar 27, 2015Updated 10 years ago
- extract third order force constants from TDEP output☆10Jun 22, 2020Updated 5 years ago
- Embedding module for VASP and tools for its use.☆10Feb 20, 2025Updated last year
- A tool to draw Graphene Oxide 3D chemical structures. (Python 2.7)☆11Nov 27, 2017Updated 8 years ago
- python wrapper for fdmnes data input/output☆14Feb 16, 2026Updated last week
- This is the proof of concept, how a relatively unsophisticated statistical model trained on the large MPDS dataset predicts physical prop…☆11Oct 31, 2024Updated last year
- Converts HDF5 files from EIGER detectors to miniCBF format☆10Dec 14, 2018Updated 7 years ago
- Oasys School☆11Apr 28, 2022Updated 3 years ago
- mdlabbook is a markdown-format lab notebook☆11Jan 11, 2017Updated 9 years ago
- ☆10May 3, 2019Updated 6 years ago
- Utilities for ab initio modeling suite CRYSTAL, developed in Turin University☆11Aug 28, 2025Updated 5 months ago
- ☆16Dec 17, 2024Updated last year
- dlePy☆10Dec 25, 2021Updated 4 years ago
- simple example of using the OpenGL Core Profile with PyQt, numpy, and PyOpenGL☆15Nov 30, 2012Updated 13 years ago
- A collection of some generic template question for algorithm interview questions☆11May 23, 2022Updated 3 years ago
- ☆11Mar 6, 2019Updated 6 years ago