Awesome Open Source
Search
Programming Languages
Languages
All Categories
Categories
About
Search results for physics chemistry
chemistry
x
physics
x
73 search results found
Psi4
⭐
875
Open-Source Quantum Chemistry – an electronic structure package in C++ driven by Python
Cp2k
⭐
722
Quantum chemistry and solid state physics software package
Thermo
⭐
517
Thermodynamics and Phase Equilibrium component of Chemical Engineering Design Library (ChEDL)
Itensor
⭐
347
A C++ library for efficient tensor network calculations
Orthopy
⭐
179
📐 Orthogonal polynomials in all shapes and sizes.
Opem
⭐
178
OPEM (Open Source PEM Fuel Cell Simulation Tool)
Chemlab
⭐
173
The chemistry library you were waiting for
Darwin
⭐
97
An open-source project dedicated to build foundational large language model for natural science, mainly in physics, chemistry and material science.
Fermi.jl
⭐
92
Fermi quantum chemistry program
Matbench
⭐
88
Matbench: Benchmarks for materials science property prediction
Pyabel
⭐
83
A python package for Abel and inverse Abel transforms
Geom3d
⭐
75
Geom3D: Geometric Modeling on 3D Structures, NeurIPS 2023
Mcmd
⭐
74
Monte Carlo and Molecular Dynamics Simulation Package
Cellpy
⭐
66
extract and tweak data from electrochemical tests of cells
Ml4chem
⭐
64
ML4Chem: Machine Learning for Chemistry and Materials
Chemcoord
⭐
58
A python module for manipulating cartesian and internal coordinates.
Electronvisualized
⭐
53
Public Archive: Beautiful and Elegant Quantum Mechanics Visualization.
Pem Dataset1
⭐
43
Proton Exchange Membrane (PEM) Fuel Cell Dataset
Mpmc
⭐
42
A Monte Carlo molecular simulation software especially suited for materials simulations with polarizable models
Anki Periodic Table Memory Pegs
⭐
42
Periodic Table flashcard deck for Ankl
Nucleogenesis
⭐
36
Nucleogenesis JS incremental game
Symmer
⭐
35
An efficient Python-based framework for implementing qubit subspace methods, reducing the resource requirements for near-term quantum simulations.
Fys4480
⭐
33
Course at the graduate level on Quantum mechanics for many-particle systems. The link to lecture notes in the form of a jupyter-book is at https://manybodyphysics.github.io/FYS4480/doc/Lect
Thermoparser
⭐
31
A tool for streamlining data analysis and visualisation for thermoelectrics and charge carrier transport in computational materials science.
Soaplite
⭐
31
Fast lightweight SOAP implementation for machine learning in quantum chemistry and materials physics.
Fisiquimicamente
⭐
31
FisiQuímicamente / PhysiChemically / FisiQuímicament
Pynta
⭐
29
Pynta - an automated workflow for reaction path exploration on metallic surfaces
Nanonet
⭐
27
The project represents an extendable Python framework for the electronic structure computations based on the tight-binding method and transport modeling based on the non-equilibrium Green's function (NEGF) method. The code can deal with both finite and periodic system translated in one, two or three dimensions.
Gopem
⭐
27
GUI for OPEM library
Uclchem
⭐
26
UCLCHEM - A gas-grain chemical code for Astrochemistry.
Scialgs.jl
⭐
24
Fundamental scientific algorithms in Julia
Mrchem
⭐
24
MultiResolution Chemistry
Autoforce
⭐
23
Sparse Gaussian Process Potentials
Hymd
⭐
21
Massively parallel hybrid particle-field molecular dynamics in Python.
Cmlkit
⭐
21
tools for machine learning in condensed matter physics and quantum chemistry
Rdfpy
⭐
21
A Python module for fast computation of 2D and 3D radial distribution functions (RDFs).
Gebpy
⭐
20
GebPy is a Python-based, open source tool for the generation of geological data of minerals, rocks and complete lithological sequences. The data can be generated randomly or with respect to user-defined constraints, for example a specific element concentration within minerals and rocks or the order of units within a complete lithological profile.
Quantarhei
⭐
20
Open Quantum System Theory for Molecular Systems
Books
⭐
18
"Books are my escape from my own mind." ― Pual Auster
Exam Study Material
⭐
17
"Develop a passion for learning. If you do, you will never cease to grow." ― Anthony J. D'Angelo
Ase Espresso
⭐
17
ase interface for Quantum Espresso
Mutorials
⭐
16
A free, adaptive, open-source trainer for physics, chemistry, and biology students.
Pylj
⭐
16
Teaching Utility for Classical Atomistic Simulation.
Pbcpy
⭐
16
Python package providing some useful tools when dealing with molecules and materials under periodic boundary conditions and uniform grids. This is a mirror of https://gitlab.com/ales.genova/pbcpy
Peakaboo
⭐
16
XRF Analysis Software
Fundamental
⭐
16
Software to look for interrelationships between constants and find formulas for number sequences
Vankampen Stochastic
⭐
16
Exercises and notes for N.G. Van Kampen's Stochastic Processes in Physics and Chemistry
Pytopomat
⭐
15
Python Topological Materials (pytopomat) is a code for easy, high-throughput analysis of topological materials.
Freespringerbook
⭐
13
Download Free List book of Springer. [PDF format]
Equation Sheets
⭐
12
Equation sheets of STEM courses at the University of Washington (UW). Topics include chemistry, physics, calculus, applied mathematics, and chemical engineering.
Pumml
⭐
11
Positive and Unlabeled Materials Machine Learning (pumml) is a code that uses semi-supervised machine learning to classify materials from only positive and unlabeled examples.
Web
⭐
10
An Intelligent e-Scientific Lab room assistant for college student's to get the analytical results and accuracy of each observation. 🔬 💡
Benchmarks
⭐
10
HPC Benchmarks for most popular applications in Chemistry, Physics, Biology, and some other related subjects
Nano Qmflows
⭐
9
Package containing several workflows to compute molecular properties for nanomaterials
Astronomica
⭐
9
A python library for astronomy.
Lcep
⭐
9
Low-cost engineering preparation: A list of curated resources that can help people with following three conditions
Dbfc Dataset
⭐
8
Single DBFC Dataset
Antique.jl
⭐
8
Self-contained, Well-Tested, Well-Documented Analytical Solutions of Quantum Mechanical Equations
Pymembrane
⭐
8
Advanced Coarse-Grained Membrane Simulation
Xopt
⭐
8
eXternal OPTimizer for quantum chemistry
Periodictable
⭐
7
Water Steam If97
⭐
7
Ultra-high-resolution water and steam property calculation, based on IAPWS-IF 97
Numericalmethods
⭐
7
Contains Jupyter notebooks and other materials prepared for the course Numerical Methods offered at TIFR Hyderabad (https://moldis-group.github.io/teaching.html)
Coulombgalore
⭐
7
C++ Library for Electrostatics
Awesome Science
⭐
7
Collection of awesome science related resources
Python Computational Natural Sciences
⭐
7
🔬 Python Scripts for applications in Natural Sciences (Physics, Biology, Chemistry). Updating on a regular basis.
Soprano
⭐
6
Soprano - a Python library to crack crystals!
Hetbuilder
⭐
6
Builds 2D heterostructures via coincidence lattice theory.
Analyticlab
⭐
6
A Python library for experimental data calculation, treatment and display, which can be used for College Physics Experiment, Analytical Chemistry, etc.
Jee Mains Advance
⭐
6
Scitool
⭐
6
Mac App with Scientific Calculators and Simulators
Planck
⭐
5
A simple script to plot the Planck's law.
Canopy App
⭐
5
Stand-alone/column canopy codes and parameterizations
Related Searches
Python Physics (952)
C Plus Plus Physics (889)
Javascript Physics (702)
Video Game Physics (670)
Python Chemistry (486)
Jupyter Notebook Physics (392)
1-73 of 73 search results
Privacy
|
About
|
Terms
|
Follow Us On Twitter
Copyright 2018-2024 Awesome Open Source. All rights reserved.