yamatoxkatana/first-principles-thinking

Know about First Principles Thinking

Size: 1.95 KB - Last synced at: 12 days ago - Pushed at: about 2 years ago - Stars: 1 - Forks: 0

Z2PackDev/Z2Pack

A tool for calculating topological invariants.

Language: Python - Size: 193 MB - Last synced at: about 2 months ago - Pushed at: about 2 months ago - Stars: 85 - Forks: 52

tilde-lab/pycrystal

Utilities for ab initio modeling suite CRYSTAL, developed in Turin University

Language: Python - Size: 311 KB - Last synced at: 8 days ago - Pushed at: 3 months ago - Stars: 12 - Forks: 2

kirk0830/abacus-zeolite

Highly automated workflow for simulating zeolite at DFT level with ABACUS (developing)

Language: Python - Size: 31.3 KB - Last synced at: 3 months ago - Pushed at: 3 months ago - Stars: 0 - Forks: 0

dynajoe/tinydb

Database server written from scratch

Language: Go - Size: 311 KB - Last synced at: 15 days ago - Pushed at: about 2 years ago - Stars: 14 - Forks: 2

Ping-Group-UCSC/PL-lineshape-code

First principles photoluminescence code repository

Language: Python - Size: 3.08 MB - Last synced at: 4 months ago - Pushed at: 4 months ago - Stars: 1 - Forks: 2

espenfl/t4me

T4ME - Transport 4 MatErials - A code to calculate the charge transport in materials, from analytic models and ab-initio

Language: Python - Size: 31.7 MB - Last synced at: 8 days ago - Pushed at: over 5 years ago - Stars: 5 - Forks: 5

sanjar-notes/backend

Backend web development fundamentals

Size: 4.99 MB - Last synced at: 7 months ago - Pushed at: 7 months ago - Stars: 0 - Forks: 0

Ping-Group-UCSC/Tutorials

General assortment of useful tutorials for first-principles calculations

Language: Python - Size: 319 MB - Last synced at: 7 months ago - Pushed at: 11 months ago - Stars: 2 - Forks: 0

geem-lab/overreact

⚛️📈 Create and analyze chemical microkinetic models built from computational chemistry data. Crafted at the @geem-lab.

Language: Python - Size: 96.3 MB - Last synced at: 12 months ago - Pushed at: 12 months ago - Stars: 48 - Forks: 7

QEF/SternheimerGW

many-body perturbation theory without empty states

Language: Fortran - Size: 12.6 MB - Last synced at: 5 months ago - Pushed at: almost 7 years ago - Stars: 11 - Forks: 5

peferron/nand2tetris

Build a modern computer from first principles.

Language: JavaScript - Size: 89.8 KB - Last synced at: about 1 year ago - Pushed at: over 8 years ago - Stars: 0 - Forks: 1

geem-lab/overreact-guide

⚛️📈 Create and analyze chemical microkinetic models built from computational chemistry data

Language: Jupyter Notebook - Size: 3.95 MB - Last synced at: 12 months ago - Pushed at: over 2 years ago - Stars: 6 - Forks: 2

0xphen/crypto-algo-rs

Collection of selected cryptographic algorithms implemented in Rust 🦀.

Language: Rust - Size: 6.08 MB - Last synced at: over 1 year ago - Pushed at: over 1 year ago - Stars: 0 - Forks: 0

Ping-Group-UCSC/zfs-code

Zero Field Splitting Code Repository

Language: Fortran - Size: 19.7 MB - Last synced at: over 1 year ago - Pushed at: over 1 year ago - Stars: 0 - Forks: 0

Ping-Group-UCSC/random-walk-polaron-mobility

Random walk simulation of polaron hopping via kinetic monte carlo sampling

Language: C++ - Size: 1.72 MB - Last synced at: over 1 year ago - Pushed at: over 1 year ago - Stars: 0 - Forks: 0

Ping-Group-UCSC/NonRad

This code computes the nonradiative recombination at defect centers from first-principles

Language: Python - Size: 1.32 MB - Last synced at: over 1 year ago - Pushed at: almost 4 years ago - Stars: 1 - Forks: 0

fenning-research-group/DBL

Detailed Balance Limit for PV

Language: Jupyter Notebook - Size: 1.44 MB - Last synced at: about 1 year ago - Pushed at: almost 2 years ago - Stars: 1 - Forks: 0

cedrickchee/learn-software-internals Fork of codecrafters-io/build-your-own-x

Learn software internals by building your own project from scratch.

Size: 783 KB - Last synced at: about 1 year ago - Pushed at: about 3 years ago - Stars: 0 - Forks: 0

parthendo/Digit-Recognition-ANN

Training an artificial neural network using back-propagation on MNIST dataset

Language: Matlab - Size: 48.6 MB - Last synced at: about 2 years ago - Pushed at: over 6 years ago - Stars: 6 - Forks: 6

brandimarte/idisorder

Electronic transport of devices with random defects and inelastic scattering.

Language: Fortran - Size: 1.27 MB - Last synced at: about 2 years ago - Pushed at: almost 6 years ago - Stars: 3 - Forks: 0

KAIST-ELST/DMFTpack

Language: C++ - Size: 4.68 MB - Last synced at: almost 2 years ago - Pushed at: almost 2 years ago - Stars: 3 - Forks: 1

brandimarte/vibrations

PhOnonS ITeratIVE VIBRATIONS - for vibrational and electron-phonon coupling analysis via first-principles.

Language: C - Size: 881 KB - Last synced at: about 2 years ago - Pushed at: almost 6 years ago - Stars: 3 - Forks: 1

gwwfromcs/NanoGW_optimized

This code is built from the original NanoGW code written by M. Tiago. New experimental features (such as interpolative separable density fitting method) are added to accelerate calculations.

Language: Fortran - Size: 382 KB - Last synced at: about 2 years ago - Pushed at: over 6 years ago - Stars: 2 - Forks: 0

davedx/aerine

Aerine is an attempt to create a new web framework from first principles

Language: JavaScript - Size: 3.85 MB - Last synced at: about 12 hours ago - Pushed at: about 7 years ago - Stars: 0 - Forks: 0

yw-fang/ase-espresso Fork of vossjo/ase-espresso

ASE interface for Quantum Espresso

Language: Python - Size: 222 KB - Last synced at: about 2 years ago - Pushed at: almost 8 years ago - Stars: 1 - Forks: 0