wqtangecust

wqtangecust's Stars

• binary-husky/gpt_academic

  为GPT/GLM等LLM大语言模型提供实用化交互接口，特别优化论文阅读/润色/写作体验，模块化设计，支持自定义快捷按钮&函数插件，支持Python和C++等项目剖析&自译解功能，PDF/LaTex论文翻译&总结功能，支持并行问询多种LLM模型，支持chatglm3等本地模型。接入通义千问, deepseekcoder, 讯飞星火, 文心一言, llama2, rwkv, claude2, moss等。

  Language:Python62.7k2631.5k7.8k

• WassimTenachi/PhySO

  Physical Symbolic Optimization

  Language:Python1.8k3744246

• idaholab/moose

  Multiphysics Object Oriented Simulation Environment

  Language:C++1.7k8512.2k1k

• glotzerlab/freud

  Powerful, efficient particle trajectory analysis in scientific Python.

  Language:C++2631445048

• simongravelle/lammps-input-files

  LAMMPS inputs and data files

  2195191

• NFFT/nfft

  The official NFFT library repository

  Language:C173249744

• theochem/tinydft

  A minimalistic atomic Density Functional Theory (DFT) code

  Language:Python11511322

• zhangzhengde0225/VaspCZ

  VaspCZ: an Efficient VASP Computation Assistant Program, with High Throughput Computing. 包含静态优化、过渡态计算、振动分析等

  Language:Python1034125

• Roy-Kid/lammpscn

  645524

• DMFTwDFT-project/DMFTwDFT

  DMFTwDFT: An open-source code combining Dynamical Mean Field Theory with various Density Functional Theory packages

  Language:Fortran502713

• robinzyb/cp2kdata

  cp2k postprocessing tools

  Language:Python4932218

• gustavochm/sgtpy

  Language:Python3661414

• chenxin199261/MEPplot

  A GUI program for plotting Minimal energy path on potential energy surface.

  Language:Python28105

• EACcodes/PROFESS

  PRinceton Orbital-Free Electronic Structure Software

  Language:Fortran288115

• jiangj-physchem/Atif

  Language:C++16106

• CBDD/pyMDmix

  Language:Python123210

• EACcodes/VASPEmbedding

  Embedding module for VASP and tools for its use.

  Language:Fortran8504

• jmcdaniel43/Structure_factor_FFT

  This code computes structure factors using the PME approach. Either the electron density structure factor can be computed for X-ray scattering (uses form factors), or the total charge density can be computed (uses input force field charges) to evaluate sum rules

  Language:Fortran6005

• Tramonto/Tramonto

  Primary source code repository for Tramonto - software that can be used to model nanostructured fluids using Density Functional Theories and Trilinos solvers

  Language:C66

• ZXGao97/VPMR

  Approximate non-singular kernel functions by sum-of-exponentials or sum-of-gaussians by VP sum and model reduction.

  Language:MATLAB6101

• brown4972/JRB_fDFT

  MATLAB code for fluids density functional theory

  Language:MATLAB4203

• Tramonto/tramonto.github.io

  Website for Tramonto: Software for Nanostructured Fluids based on Density Functional Theory methods using Trilinos solvers:

  Language:CSS46

• zhaoyongfeng1990/DDM

  Differential Dynamic Microscopy

  Language:C++4

• markovmodel/msmrd2

  Language:C++31701

• zhaoyongfeng1990/simMIPS

  Molecular dynamic simulation of interacting active particles. Run-and-tumble particles or active Brownian particles. Interacting with pairwise forces, or quorum sensing.

  Language:C++32

• mjohn218/FPR_rot

  Rotational rigid-body reaction-diffusion code

  Language:C++2300

• zhaoyongfeng1990/spectral_solver

  Solver for nonlinear diffusion equations on disk, using pseudo spectral method with Chebyshev-Fourier series.

  Language:C++210

• pynanotools/pynanotools

  Collection of 'nano' (tiny) Python scripts for nanomaterial simulations.

  Language:Python1

• zhaoyongfeng1990/2d_on_lattice_with_growth

  Simulating ecoli on 2d lattice, considering growth and death

  Language:C1

• zhaoyongfeng1990/zhaoyongfeng1990.github.io

  Language:HTML11