Shibu778
Ph.D. Student, Materials Research Centre, Indian Institute of Science Bangalore
Indian Institute of Science BangaloreBangalore, Karnataka, India
Pinned Repositories
CompPhysicsNotebooks
Jupyter Python Notebooks of "Computational Physics", Landau, Paez, Bordeianu
defectpl
A unified package for post-processing optical properties of point defects from first principles calculation.
Density-Functional-Theory
Fundamentals and Applications of Density Functional Theory with Interactive Live Scripts and Intuitive Codes
kgrid
Calculate the required k-point density from the input geometry for periodic quantum chemistry calculations
LaDa
High-Throughput Computational Physics Framework
matgenb
Jupyter notebooks demonstrating the utilization of open-source codes for the study of materials science.
matgl
Graph deep learning library for materials
passivate_nanostructure
Passivating the dangling bonds of the outer atoms of a nanodots/nanoparticle with different elements.
PythonCompphys
Some python workbooks with various topics from Computational Physics
structure2symmetry
A python command line interface to obtain symmetry information from structure file.
Shibu778's Repositories
Shibu778/PythonCompphys
Some python workbooks with various topics from Computational Physics
Shibu778/ase
Atomic Simulation Environment - unofficial mirror from https://gitlab.com/ase/ase
Shibu778/matplotlib-tutorial
Matplotlib tutorial for beginner
Shibu778/Python
All Algorithms implemented in Python
Shibu778/python-mini-project
An open-source Python project series where beginners can contribute and practice coding.
Shibu778/academic-responsive-template
Academic Responsive (AR) Website Template
Shibu778/academic-website-template
Jekyll website template for personal academic or research group web pages.
Shibu778/Chaos-Tutorial
This is a tutorial to learn about chaotic data analysis.
Shibu778/MyNotebooks
Shibu778/AMP2
Shibu778/aNANt-dev
Developer repository for aNANt materials database
Shibu778/awesome-cpp
A curated list of awesome C++ (or C) frameworks, libraries, resources, and shiny things. Inspired by awesome-... stuff.
Shibu778/C-Plus-Plus
Collection of various algorithms in mathematics, machine learning, computer science and physics implemented in C++ for educational purposes.
Shibu778/cuda-training-series
Training materials associated with NVIDIA's CUDA Training Series (www.olcf.ornl.gov/cuda-training-series/)
Shibu778/deepmind-research
This repository contains implementations and illustrative code to accompany DeepMind publications
Shibu778/dftfe
DFT-FE: Real-space DFT calculations using Finite Elements
Shibu778/Explain-it-Tutorial
Shibu778/four-probe-experiment
Virtual Environment for four probe experiment
Shibu778/GreenCheetah
Non-Equilibrium Green's function approach for quantum transport
Shibu778/group-website
This repository is for developing the group website.
Shibu778/IBM-Qiskit-Summer-School-2020
IBM Qiskit Global Summer School (20 July 2020 to 31 July 2020)
Shibu778/Javascript
A repository for All algorithms implemented in Javascript (for educational purposes only)
Shibu778/MicroSim
MicroSim is a project under the National Supercomputing Mission, Govt of India. The project offers a set of codes that can use high performance computing to simulate microstructure evolution using the Phase Field technique.
Shibu778/pyiron_atomistics
pyiron_atomistics - an integrated development environment (IDE) for atomistic simulation in computational materials science.
Shibu778/pylada-light
A physics computational framework for python and ipython
Shibu778/QGSS-2021
Qiskit Global Summer School 2021 hosted by IBM Quantum, focused on Quantum Machine Learning.
Shibu778/QiskitGlobalSummerSchool2022
Shibu778/The-C-20-Masterclass-Source-Code
Source code for the C++ 20 Masterclass on udemy
Shibu778/TransOpt
The package TransOpt makes it possible for VASP users to calculate electrical transport properties (Seebeck coefficients, electrical conductivities, and electronic thermal conductivities) by using (1) the momentum matrix method (Method 1) or (2) derivative method same as adopted in BoltzTrap (Method 2).
Shibu778/youtube_channel
Notebooks for the python tutorials of my youtube channel. See specific youtube video for link to specifc notebook.