Auxiliary-Field Methods for Quantum Materials - IPAM at UCLA
Institute for Pure & Applied Mathematics (IPAM) via YouTube
Overview
Syllabus
Auxiliary-field methods for quantum materials
Overview: MC in quantum physics
The many-electron problem
The challenge of accurate calculations
What does AFQMC do?
Connection with other QMC
Understand and control the sign problem
Ligand-dissociation of TM complexes ICTC
Electrochemistry of TM complexes
Computing observables & correlations
Computation of forces and stresses
Lattice optimization - AIN
Optimization with noisy gradients
An algorithm for noisy forces/stresses
Summary
Taught by
Institute for Pure & Applied Mathematics (IPAM)