LiangJiuyang
I am a Flatiron research fellow at the Flatiron Institute, focusing on fast algorithms. I received my PhD from Shanghai Jiao Tong University in 2023.
Flatiron Institute, Simons FoundationFlatiron research fellow
Pinned Repositories
HSMA-Harmonic-surface-mapping-algorithm-in-LAMMPS
Implement HSMA3D and HSMA2D into LAMMPS as a K-space module
Harmonic-Surface-Mapping-Algorithm-on-CPU-and-GPU
Harmonic Surface Mapping Algorithm, described in paper [ Harmonic surface mapping algorithm for fast electrostatic sums ].
VPMR
Approximate non-singular kernel functions by sum-of-exponentials or sum-of-gaussians by VP sum and model reduction.
SumOfExponentials.jl
Julia implementation of the VPMR method for constructing an SOE
lammps-rbe
This is the LAMMPS code of the random batch Ewald method. If you have any questions, feel free to contact us.
gromacs-rbe
The GROMACS interface of the random batch Ewald (RBE) method
deepmd-kit
A deep learning package for many-body potential energy representation and molecular dynamics
FMM3D
Flatiron Institute Fast Multipole Libraries --- This codebase is a set of libraries to compute N-body interactions governed by the Laplace and Helmholtz equations, to a specified precision, in three dimensions, on a multi-core shared-memory machine.
lammps
Public development project of the LAMMPS MD software package
LiangJiuyang.github.io
Github Pages template for academic personal websites, forked from mmistakes/minimal-mistakes
LiangJiuyang's Repositories
LiangJiuyang/LiangJiuyang.github.io
Github Pages template for academic personal websites, forked from mmistakes/minimal-mistakes
LiangJiuyang/deepmd-kit
A deep learning package for many-body potential energy representation and molecular dynamics
LiangJiuyang/gromacs-rbe
The GROMACS interface of the random batch Ewald (RBE) method
LiangJiuyang/lammps-rbe
This is the LAMMPS code of the random batch Ewald method. If you have any questions, feel free to contact us.
LiangJiuyang/SumOfExponentials.jl
Julia implementation of the VPMR method for constructing an SOE
LiangJiuyang/Sum-of-Exponentials-Approximation
This repository records both the weights and exponents of the SOE produced by the VPMR, a recently developed sum-of-exponentials method.
LiangJiuyang/HSMA-Harmonic-surface-mapping-algorithm-in-LAMMPS
Implement HSMA3D and HSMA2D into LAMMPS as a K-space module
LiangJiuyang/VPMR
Approximate non-singular kernel functions by sum-of-exponentials or sum-of-gaussians by VP sum and model reduction.
LiangJiuyang/vpmr-1
C++ implementation of the VPMR algorithm
LiangJiuyang/FMM3D
Flatiron Institute Fast Multipole Libraries --- This codebase is a set of libraries to compute N-body interactions governed by the Laplace and Helmholtz equations, to a specified precision, in three dimensions, on a multi-core shared-memory machine.
LiangJiuyang/lammps
Public development project of the LAMMPS MD software package
LiangJiuyang/Harmonic-Surface-Mapping-Algorithm-on-CPU-and-GPU
Harmonic Surface Mapping Algorithm, described in paper [ Harmonic surface mapping algorithm for fast electrostatic sums ].