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GUI for running simulations with universal machine learning interatomic potentials (MACE, CHGNet, SevenNet, Nequix, ORB, MatterSim, PET-MAD))

Python 17 Updated Dec 19, 2025
Python 14 3 Updated Jul 7, 2024

A user friendly solver with GUI for 1D quantum problem and QCL simulation

Python 15 5 Updated Feb 13, 2025

EAPOT is an integrated software platform developed by the research group of Professor Ruifeng Zhang at Beihang University in recent five years to build empirical interatomic potential.

8 2 Updated Sep 22, 2022

Python tool for converting files and office documents to Markdown.

Python 84,524 4,867 Updated Dec 1, 2025

A calculator that calculate reflectance, transmittance, and absorption based on transfer matrix method.

Jupyter Notebook 2 1 Updated Sep 27, 2023

A Collection of AI's Prompts for optimal context

22 1 Updated Aug 22, 2025

the simplest self-building coding agent

Python 1,054 166 Updated Oct 19, 2024

A solver for the coupled and decoupled electron and phonon Boltzmann transport equations.

Fortran 55 32 Updated Dec 17, 2025

This repository contains the data associated with the research paper titled "Measurement of the quantum-confined Stark effect in InAs/In(Ga)As quantum dots with p-doped quantum dot barriers," publi…

Python 2 Updated Nov 27, 2023

Official repository for Spyder - The Scientific Python Development Environment

Python 9,070 1,748 Updated Dec 23, 2025

Chat first code editor. To download the packaged app:

TypeScript 5,446 370 Updated Nov 14, 2024

QuTiP: Quantum Toolbox in Python

Python 1,934 728 Updated Dec 17, 2025

HEOM-QUICK2 is a general-purpose software package that enables accurately solving the stationary state and non-Markovian dynamics for fermionic many-body OQS. Integrated with quantum chemistry soft…

Fortran 5 2 Updated Nov 24, 2025

Ensemble Monte Carlo code for semiconductors and metals

C++ 8 6 Updated Aug 24, 2023

Derivative work forked from the awesome rbende

Tcl 6 Updated Jan 26, 2025

Analysis of quantum chemical interactions in molecules and solids.

Fortran 113 36 Updated Dec 10, 2025

doped is a Python software for the generation, pre-/post-processing and analysis of defect supercell calculations, implementing the defect simulation workflow in an efficient, reproducible, user-fr…

Python 227 38 Updated Dec 21, 2025

Visualization of related subreddits

JavaScript 1,400 125 Updated Mar 14, 2025

Fiber Bragg grating (FBG) simulation tool for Finite Element Method (FEM) models. Features inclusion of temperature dependency and emulation within the program. The user can supply a data file and …

Python 39 11 Updated Oct 24, 2022

Software FBG_SiMul: Fibre Bragg Grating Sinal Simulation Tool for Finite Element Method Models

Python 10 10 Updated Dec 19, 2016

🚀 Power Your World with AI - Explore, Extend, Empower.

JavaScript 8,185 650 Updated Sep 15, 2025

A fast, lightweight 3D viewer for Python based on WGPU

Python 56 1 Updated Nov 24, 2025

The Todo List / Task Manager for Geeks in command line

Go 545 26 Updated Dec 9, 2023

Ab initio tight binding simuation package

Python 37 11 Updated Dec 3, 2025

PiNN2 is a easy-to-use framework for device compact modeling using physics-inspired neural networks

Python 15 9 Updated Jan 28, 2019

🙌 OpenHands: AI-Driven Development

Python 65,872 8,105 Updated Dec 23, 2025

Interactive roadmaps, guides and other educational content to help developers grow in their careers.

TypeScript 345,937 43,539 Updated Dec 23, 2025

gpaw-tools is a powerful and user-friendly UI/GUI tool for conducting Density Functional Theory (DFT) and molecular dynamics (MD) calculations

Python 28 11 Updated Oct 1, 2025

A python package to compute zero-field-splitting tensors for molecules and spin quantum bits in semiconductors.

Python 13 12 Updated Mar 30, 2020
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