Pinned Repositories
CPMCPY
This is a python AFQMC base on CPMC-Lab a matlab code for the Hubbard Model capable of periodic and twisted boundary conditions
BO_Research
champ
The Cornell-Holland Ab-initio Materials Package (CHAMP) is a quantum Monte Carlo suite of programs for electronic structure calculations of atomic and molecular systems.
CrashQMC
Curso Intensivo de Monte Carlo Para la Universidad Industrial de Santander Marzo 2019
Example-Gpytorch-BIC
Simple example using BIC modifying gpytorch basic tutorial
ipie
ipie stands for Intelligent Python-based Imaginary-time Evolution with a focus on simplicity and speed.
LHC_Database
This is a public repository with the database for the Hydrogen linear chains with homogenous stretching for the paper "Gaussian Processes for Finite Size Extrapolation of Many-Body Simualtions", the data base contains the total energy in Ha and the bond lengths in Bohr, in the base STO-6G and using open boundary conditions for CCSD(T) performed with Pyscf and AFQMC performed with QMCPACK
miniAFQMC
A simplified auxiliary field QMC code for algorithm development, performance portability testing, and computer science experiments
numerical-linear-algebra
Free online textbook of Jupyter notebooks for fast.ai Computational Linear Algebra course
numpy-ml
Machine learning, in numpy
josuelandinez's Repositories
josuelandinez/CPMCPY
This is a python AFQMC base on CPMC-Lab a matlab code for the Hubbard Model capable of periodic and twisted boundary conditions
josuelandinez/BO_Research
josuelandinez/champ
The Cornell-Holland Ab-initio Materials Package (CHAMP) is a quantum Monte Carlo suite of programs for electronic structure calculations of atomic and molecular systems.
josuelandinez/qmckl_gpu
Test repository for a dedicated QMCkl GPU library
josuelandinez/qmckl_minicode
josuelandinez/tuthpc
Tutorial on "Efficient Python for High-Performance Computing"
josuelandinez/CrashQMC
Curso Intensivo de Monte Carlo Para la Universidad Industrial de Santander Marzo 2019
josuelandinez/The-Art-of-Linear-Algebra
Graphic notes on Gilbert Strang's "Linear Algebra for Everyone"
josuelandinez/qmckl
Quantum Monte Carlo Kernel Library
josuelandinez/ipie
ipie stands for Intelligent Python-based Imaginary-time Evolution with a focus on simplicity and speed.
josuelandinez/trexio_tools
Set of tools for trexio files
josuelandinez/qmcpack
Main repository for QMCPACK, an open-source production level many-body ab initio Quantum Monte Carlo code for computing the electronic structure of atoms, molecules, and solids with full performance portable GPU support
josuelandinez/numerical-linear-algebra
Free online textbook of Jupyter notebooks for fast.ai Computational Linear Algebra course
josuelandinez/LHC_Database
This is a public repository with the database for the Hydrogen linear chains with homogenous stretching for the paper "Gaussian Processes for Finite Size Extrapolation of Many-Body Simualtions", the data base contains the total energy in Ha and the bond lengths in Bohr, in the base STO-6G and using open boundary conditions for CCSD(T) performed with Pyscf and AFQMC performed with QMCPACK
josuelandinez/Example-Gpytorch-BIC
Simple example using BIC modifying gpytorch basic tutorial
josuelandinez/numpy-ml
Machine learning, in numpy
josuelandinez/miniAFQMC
A simplified auxiliary field QMC code for algorithm development, performance portability testing, and computer science experiments