Published February 1, 2005 | Version v1
Journal article

The Truncated Polynomial Expansion Monte Carlo Method for Fermion Systems Coupled to Classical Fields: A Model Independent Implementation

  • 1. Oak Ridge National Laboratory, TN (United States)
  • 2. Florida State University, Tallahassee, FL (United States)
  • 3. Aoyama Gakuin University, Kanagawa (Japan)
  • 4. RIKEN (Japan)

Description

A software library is presented for the polynomial expansion method (PEM) of the density of states (DOS) introduced in. The library provides all necessary functions for the use of the PEM and its truncated version (TPEM) in a model independent way. The PEM/TPEM replaces the exact diagonalization of the one electron sector in models for fermions coupled to classical fields. The computational cost of the algorithm is O(N)-with N the number of lattice sites-for the TPEM which should be contrasted with the computational cost of the diagonalization technique that scales as O(N4). The method is applied for the first time to a double exchange model with finite Hund coupling and also to diluted spin-fermion models.

Additional details

Publishing Information

Journal Title
Computer Physics Communications
Journal Volume
168
Journal Page Range
p. 32-45
ISSN
0010-4655
CODEN
CPHCBZ

Optional Information

Contract/Grant/Project number
KC0202030; ERKCS08; AC05-00OR22725
Notes
doi 10.1016/j.cpc.2005.02.001
Funding organization
SC USDOE - Office of Science (United States)