Mario Motta - Università degli Studi di Milano #
Dynamical imaginary-time correlations from Auxiliary Fields Quantum Monte Carlo #
Quantum Monte Carlo (QMC) simulations of many body fermionic systems are considerably
complicated by the well known sign problem [1]. Although very accurate approximation
schemes have been developed for the calculation of static properties, like structure
functions and energy, the possibility of extending such methodologies to the investigation
of dynamical properties is still largely unexplored [2].
Recently, a number of innovative QMC methods have been conceived which map the imaginary
time evolution into a random walk in the abstract manifold of Slater determinants.
In such approaches the sign problem is not circumvented and still requires approximations,
but emerges in a different - and hopefully easier to handle - way.
We have focused on the phaseless auxiliary Fields QMC method (AFQMC), developed by Shiwei
Zhang[3]. Generalizing the formal manipulations suggested by Assaad et al. [4], we propose
a practical scheme to evaluate dynamic correlation functions in imaginary time, giving
access to the study of excitations and response functions of interacting fermionic systems.
We have explored systematically the effects of the phaseless approximation, underlying the
AFQMC technique and its dynamical generalization, via the study of exactly solvable simple
models, comparing AFQMC predictions with exact solutions.
We will present also results about a two-dimensional electron liquid, providing comparisons
with other QMC techniques.
In collaboration with: D.E.Galli, S. Moroni and E.Vitali
REFERENCES:
[1] R.P. Feynman, A.R. Hibbs, Quantum Mechanics and Path Integrals, McGraw-Hill (1965)
[2] M. Nava, D. Galli, S. Moroni and E. Vitali: arXiv:1302.1799 (2013)
[3] S. Zhang: 'Quantum Monte Carlo Methods for Strongly Correlated Electron Systems',
in Theoretical Methods for Strongly Correlated Electron Systems, Springer Verlag (2003)
[4] M. Feldbacher and F. F. Assaad: Phys. Rev. B 63, 073105 (2001)