Pe. Kornilovitch, Ground-state dispersion and density of states from path-integral Monte Carlo: Application to the lattice polaron, PHYS REV B, 60(5), 1999, pp. 3237-3243
A formula is derived that relates the ground-state dispersion of a many-bod
y system with the end-to-end distribution of paths with open boundary condi
tions in imaginary time. The formula does not involve the energy estimator.
It allows direct measurement of the ground-state dispersion by quantum Mon
te Carlo methods without analytical continuation or auxiliary fitting. The
formula is applied to the lattice polaron problem. The exact polaron spectr
um and density of states are calculated for several models in one, two, and
three dimensions. In the adiabatic regime of the Holstein model, the polar
on density of states deviates spectacularly from the free-particle shape. [
S0163-1829(99)05529-0].