Fitting for XPS (x-ray photoelectron spectra) (rewrite of schachmett/xpl)
☆12Jul 6, 2023Updated 2 years ago
Alternatives and similar repositories for gxps
Users that are interested in gxps are comparing it to the libraries listed below. We may earn a commission when you buy through links labeled 'Ad' on this page.
Sorting:
- A graphical user interface of Python lmfit package was developed for standard X-ray photoemission spectroscopy (XPS) curve fitting analys…☆54Jun 13, 2025Updated 9 months ago
- Analysis of EXAFS Spectra using AI☆19Jul 2, 2023Updated 2 years ago
- A Python framework for the batch processing and deconvolution of Raman spectra of carbonaceous materials.☆28Sep 4, 2025Updated 6 months ago
- PLEASE: The Python Low-energy Electron Analysis SuitE - Enabling rapid analysis and visualization of LEEM and LEED Data.☆17Jun 30, 2021Updated 4 years ago
- A graphical user interface of Python lmfit package was developed for standard X-ray photoemission spectroscopy (XPS) curve fitting analys…☆29Dec 3, 2025Updated 3 months ago
- DigitalOcean Gradient AI Platform • AdBuild production-ready AI agents using customizable tools or access multiple LLMs through a single endpoint. Create custom knowledge bases or connect external data.
- GROMACS implementation of TraPPE-UA force field with HH-Alkane modifications☆14Sep 24, 2022Updated 3 years ago
- NMR Chemical Shifts from Molecular Dynamics Simulation☆14Sep 17, 2021Updated 4 years ago
- X-ray diffraction data analysis for high pressure and high temperature experiments☆19Mar 23, 2026Updated last week
- ☆19May 30, 2019Updated 6 years ago
- Mirror of PyARPES (gitlab/lanzara-group/python-arpes) the open source ARPES analysis framework☆46Jul 25, 2024Updated last year
- Python-code to analyse Raman spectroscopy☆14Apr 19, 2019Updated 6 years ago
- ☆13Oct 14, 2015Updated 10 years ago
- Channel Access client for LabVIEW☆14Feb 13, 2026Updated last month
- Gaussian and Lorentzian smearing of simulated spectra☆44Oct 8, 2024Updated last year
- Virtual machines for every use case on DigitalOcean • AdGet dependable uptime with 99.99% SLA, simple security tools, and predictable monthly pricing with DigitalOcean's virtual machines, called Droplets.
- Count rings in a undirected graph.☆18May 6, 2023Updated 2 years ago
- specio: Python input/output for spectroscopic files☆23Jul 8, 2024Updated last year
- Equitrain: A Unified Framework for Training and Fine-tuning Machine Learning Interatomic Potentials☆11Jan 28, 2026Updated 2 months ago
- Transform generic LLMs into specialized, fast and efficient models.☆38Updated this week
- atomRDF is a python tool for ontology-based creation, manipulation, and querying of structures. atomRDF uses the Computational Material S…☆10Mar 20, 2026Updated last week
- Source codes of the 1st VASPKIT-PAPATERA CUP Awards☆27Sep 27, 2019Updated 6 years ago
- Automatic construction of wannier functions for any 3D transition metal based system with or without SOC☆15Feb 18, 2022Updated 4 years ago
- Zeobuilder is an extensible GUI-toolkit for molecular model construction.☆13Feb 15, 2019Updated 7 years ago
- Deep-learning-based image segmentation for automatically detecting atomically thin 2D materials in optical microscope images☆15Mar 26, 2020Updated 6 years ago
- Managed Kubernetes at scale on DigitalOcean • AdDigitalOcean Kubernetes includes the control plane, bandwidth allowance, container registry, automatic updates, and more for free.
- Tools, tutorials, and wiki for GROMACS☆20Jul 21, 2020Updated 5 years ago
- High-throughput DFT of MOFs using ASE/VASP☆31May 22, 2023Updated 2 years ago
- An Avogadro plugin with a gui to create packmol input files and run packmol from within Avogadro.☆11Mar 3, 2010Updated 16 years ago
- Python code to identify and calculate decomposition of materials using Raman spectroscopy☆29Dec 31, 2020Updated 5 years ago
- Embedding module for VASP and tools for its use.☆10Feb 20, 2025Updated last year
- GRADE: A code to determine clathrate hydrate structures. GRADE analyzes atomic positions of water molecules to compute the number of 5(12…☆23Jun 19, 2023Updated 2 years ago
- 写的一些小程序会放在这里面☆24Mar 26, 2019Updated 7 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
- NMRforMD is a python script for the calculation of NMR relaxation time T1 and T2 from molecular dynamics trajectory file.☆25May 3, 2025Updated 10 months ago
- NordVPN Threat Protection Pro™ • AdTake your cybersecurity to the next level. Block phishing, malware, trackers, and ads. Lightweight app that works with all browsers.
- 高通量建立vasp模型和批量分析模型性质（High throughput VASP model and batch analysis model properties）☆13Aug 23, 2021Updated 4 years ago
- General data import tool for IgorPro☆21May 18, 2021Updated 4 years ago
- Tutorials for the sisl-TBtrans-TranSiesta suite☆44Nov 21, 2025Updated 4 months ago
- BET Surface Identification - a program that fully implements the rouquerol criteria☆16Jul 6, 2023Updated 2 years ago
- A collation of defect parameters in semiconductors☆11Dec 10, 2020Updated 5 years ago
- extract third order force constants from TDEP output☆10Jun 22, 2020Updated 5 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