randomme

randomme

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pymatgen

Python Materials Genomics (pymatgen) is a robust materials analysis code that defines core object representations for structures and molecules with support for many electronic structure codes. It is currently the core analysis code powering the Materials Project.

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100-Days-Of-ML-Code

100 Days of ML Coding

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100-Days-Of-ML-Code-chn

100-Days-Of-ML-Code中文版

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Building-Machine-Learning-Systems-with-Python-Third-edition

Code repository for Building Machine Learning Systems with Python Third Edition, by Packt

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CASMcode

First-principles statistical mechanical software for the study of multi-component crystalline solids

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codecombat

Multiplayer programming game for learning how to code.

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dbscan

Python implementation of 'Density Based Spatial Clustering of Applications with Noise'

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devsim

TCAD Semiconductor Device Simulator

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dft-book

A book on modeling materials using VASP, ase and vasp

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elastic_tensor_ML

Machine learning models for predicting the bulk modulus of materials

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example-code-2e

Example code for Fluent Python, 2nd edition (O'Reilly 2022)

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examples

Code examples from the book.

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fann

Official github repository for Fast Artificial Neural Network Library (FANN)

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gosam

generator of simple atomistic models

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handson-ml

A series of Jupyter notebooks that walk you through the fundamentals of Machine Learning and Deep Learning in python using Scikit-Learn and TensorFlow.

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jd_maotai_seckill

优化版本的京东茅台抢购神器

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KMCLib

A kinetic Monte Carlo Python/C++ library.

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kmos

kMC on steroids: A vigorous attempt to make lattice kinetic Monte Carlo modelling easier

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lammps-input-files

LAMMPS inputs and data files

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matminer

data mining for Materials Science

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phaseFieldGrainGrowth

python code for simulation of grain growth using phase field theory

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Problem-Solving-with-Algorithms-and-Data-Structures-Using-Python

Examples and work from Problem Solving with Algorithms and Data Structures Using Python

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python-machine-learning-book-2nd-edition

The "Python Machine Learning (2nd edition)" book code repository and info resource

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sqs2poscar

A c++ code to convert bestsqs.out from mcsqs (ATAT) to POSCAR for VASP.

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vim

vim配置文件和插件

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