Alternatives and similar repositories for LapNet

Users that are interested in LapNet are comparing it to the libraries listed below

• YWolfeee / lapjax
  A JAX based package designed for efficient second order operators (e.g., laplacian) computation.
  ☆74Updated last year
• bytedance / jaqmc
  JAX accelerated Quantum Monte Carlo
  ☆87Updated 3 months ago
• sail-sg / d4ft
  A JAX library for Density Functional Theory.
  ☆54Updated 5 months ago
• mdsunivie / deeperwin
  DeepErwin is a python 3.8+ package that implements and optimizes JAX 2.x wave function models for numerical solutions to the multi-electr…
  ☆63Updated 7 months ago
• wangleiphy / ml4p
  Machine learning for physicists
  ☆136Updated 2 years ago
• n-gao / pesnet
  Reference implementation of "Ab-Initio Potential Energy Surfaces by Pairing GNNs with Neural Wave Functions" (ICLR, 2022) and "Sampling-f…
  ☆31Updated last year
• fishjojo / pyscfad
  PySCF with auto-differentiation
  ☆88Updated last week
• bytedance / DeepSolid
  A library combining solid quantum Monte Carlo and neural network.
  ☆46Updated 11 months ago
• deepmodeling / CrystalFormer
  Space Group Informed Transformer for Crystalline Materials Generation
  ☆124Updated 4 months ago
• tomdbar / naqs-for-quantum-chemistry
  Supporting code for "Autoregressive neural-network wavefunctions for ab initio quantum chemistry".
  ☆42Updated 3 years ago
• XanaduAI / GradDFT
  GradDFT is a JAX-based library enabling the differentiable design and experimentation of exchange-correlation functionals using machine l…
  ☆108Updated last year
• lin-lin / 2018Fall_275
  Mathematical Introduction to Electronic Structure Theory
  ☆47Updated 6 years ago
• mala-project / mala
  Materials Learning Algorithms. A framework for machine learning materials properties from first-principles data.
  ☆97Updated 2 months ago
• diffqc / dqc
  Differentiable Quantum Chemistry (only Differentiable Density Functional Theory and Hartree Fock at the moment)
  ☆118Updated 3 years ago
• Shiling42 / XY-MODEL
  Monte Carlo simulation on 2D XY-model
  ☆25Updated 6 years ago
• bytedance / byteqc
  ☆107Updated 5 months ago
• theochem / tinydft
  A minimalistic atomic Density Functional Theory (DFT) code
  ☆142Updated this week
• sail-sg / jax_xc
  Exchange correlation functionals translated from libxc to jax
  ☆46Updated 7 months ago
• WagnerGroup / pyqmc
  Python library for real space quantum Monte Carlo
  ☆95Updated last week
• shuaigroup / Renormalizer
  Quantum dynamics package based on tensor network states
  ☆62Updated last week
• CompPhysVienna / MLSummerSchoolVienna2022
  ESI-DCAFM-TACO-VDSP Summer School on "Machine Learning for Materials Hard and Soft"
  ☆39Updated 3 years ago
• CCQC / Quax
  Arbitrary-order derivatives of popular electronic structure methods, such as Hartree-Fock and coupled cluster theory.
  ☆70Updated last year
• tencent-quantum-lab / TenCirChem
  Quantum computational chemistry based on TensorCircuit
  ☆70Updated 4 months ago
• bdhammel / ising-model
  Python implementation of the Ising model
  ☆63Updated 5 years ago
• williamratcliff / GNN-tutorial-APS-March-2023
  These are the slides associated with the GNN tutorial at the APS March Meeting
  ☆21Updated 2 years ago
• wdphy16 / stat-mech-van
  Code for 'Solving Statistical Mechanics using Variational Autoregressive Networks'.
  ☆97Updated 5 months ago
• deepqmc / deepqmc
  Deep learning quantum Monte Carlo for electrons in real space
  ☆399Updated 4 months ago
• deepmodeling / deepks-kit
  a package for developing machine learning-based chemically accurate energy and density functional models
  ☆114Updated 6 months ago
• Teoroo-CMC / PiNN
  A Python library for building atomic neural networks
  ☆120Updated last month
• RMGDFT / rmgdft
  RMG is an Open Source code for electronic structure calculations and modeling of materials and molecules. It is based on density function…
  ☆54Updated this week