arrow
Return

Temperature steerable flows and Boltzmann generators

delete2022-10-10
delete14
delete
OA
AI
M
Manuel Dibak
L
Leon Klein
A
Andreas Krämer
F
Frank Noé *
DOI:10.1103/PhysRevResearch.4.L042005delete
deleteOriginal
deleteOriginal request for help
deleteShare
deleteSave
Abstract

Abstract

En 中文
Boltzmann generators approach the sampling problem in many-body physics by combining a normalizing flow and a statistical reweighting method to generate samples in thermodynamic equilibrium. The equilibrium distribution is usually defined by an energy function and a thermodynamic state. Here, we propose temperature steerable flows (TSFs) which are able to generate a family of probability densities parametrized by a choosable temperature parameter. TSFs can be embedded in generalized ensemble sampling frameworks to sample a physical system across multiple thermodynamic states.

Journal

Physical Review Research cover
Physical Review Research
IF:
4.2
Papers:
7.6K
Citations:
2.7W

Organization

F
Free University of Berlin
Scholars:
3.8W
Papers: 3.2W
Citations: 51