• 1
• 0
• 0

FengGo/HTECSP

High-Throughput Evolutionary Crystal Structure Prediction Method

• 9
• 13
• 6

FengGo/I-ReaxFF

I-ReaxFF: stand for Intelligent-Reactive Force Field

• 1
• 0
• 0

FengGo/CrySPY

• 1
• 0
• 0

FengGo/ReaxFF-nn_for_lammps

Use ReaxFF-nn mathine learning potentail with LAMMPS

• 1
• 0
• 0

FengGo/ReaxFF-nn

ReaxFF-nn for GULP

• 1
• 0
• 0

FengGo/cdvae

• 1
• 0
• 0

FengGo/EmGen

• 1
• 0
• 0

FengGo/NeuralNetwork

A small neural network constructed by pure NumPy

• 1
• 0
• 0

FengGo/imatgen

• 1
• 0
• 0

FengGo/Composition-Conditioned-Crystal-GAN

• 1
• 0
• 0

FengGo/ThirdOrder

thirdorder, help compute anharmonic IFCs from minimal sets of displacements with GULP and LAMMPS.

• 1
• 0
• 0

FengGo/tangent

Tangent is a new, free, and open-source Python library for automatic differentiation.

• 1
• 0
• 0

FengGo/JAX-ReaxFF

JAX-ReaxFF: A Gradient Based Framework for Extremely Fast Optimization of Reactive Force Fields

• 1
• 0
• 5

FengGo/dpgen_siesta forked from LiuJianpeng/dpgen_siesta

The deep potential generator

• 1
• 0
• 0

FengGo/fenggo

website

• 1
• 0
• 0

FengGo/atomify

Atomify - a realtime LAMMPS visualizer

• 1
• 1
• 3

FengGo/deep_learning_and_the_game_of_go forked from mirrors_maxpumperla/deep_learning_and_the_game_of_go

• 1
• 0
• 0

FengGo/chemview

• 1
• 0
• 0

FengGo/flare

FLARE: Fast Learning of Atomistic Rare Events

• 1
• 0
• 0

FengGo/genetic-drawing

A genetic algorithm toy project for drawing