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Register a new userNumerical Methods for the QCD Overlap Operator IV: Hybrid Monte Carlo
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The extreme computational costs of calculating the sign of the Wilson matrix within the overlap operator have so far prevented four dimensional dynamical overlap simulations on realistic lattice sizes, because the computational power required to invert the overlap operator, the time consuming part of the Hybrid Monte Carlo algorithm, is too high. In this series of papers we introduced the optimal approximation of the sign function and have been developing preconditioning and relaxation techniques which reduce the time needed for the inversion of the overlap operator by over a factor of four, bringing the simulation of dynamical overlap fermions on medium-size lattices within the range of Teraflop-computers. In this paper we adapt the HMC algorithm to overlap fermions. We approximate the matrix sign function using the Zolotarev rational approximation, treating the smallest eigenvalues of the Wilson operator exactly within the fermionic force. We then derive the fermionic force for the overlap operator, elaborating on the problem of Dirac delta-function terms from zero crossings of eigenvalues of the Wilson operator. The crossing scheme proposed shows energy violations which are better than O($Deltatau^2$) and thus are comparable with the violations of the standard leapfrog algorithm over the course of a trajectory. We explicitly prove that our algorithm satisfies reversibility and area conservation. Finally, we test our algorithm on small $4^4$, $6^4$, and $8^4$ lattices at large masses.
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In Hybrid Monte Carlo(HMC) simulations for full QCD, the gauge fields evolve smoothly as a function of Molecular Dynamics (MD) time. Thus we investigate improved methods of estimating the trial solutions to the Dirac propagator as superpositions of the solutions in the recent past. So far our best extrapolation method reduces the number of Conjugate Gradient iterations per unit MD time by about a factor of 4. Further improvements should be forthcoming as we further exploit the information of past trajectories.
Supersymmetric Yang-Mills (SYM) theories in four dimensions exhibit many interesting non-perturbative phenomena that can be studied by means of Monte Carlo lattice simulations. However, the lattice regularization breaks supersymmetry explicitly, and in general a fine tuning of a large number of parameters is required to correctly extrapolate the theory to the continuum limit. From this perspective, it is important to preserve on the lattice as many symmetries of the original continuum action as possible. Chiral symmetry for instance prevents an additive renormalization of the fermion mass. A (modified) version of chiral symmetry can be preserved exactly if the Dirac operator fulfills the Ginsparg-Wilson relation. In this contribution, we present an exploratory non-perturbative study of N=1 supersymmetric Yang-Mills theory using the overlap formalism to preserve chiral symmetry at non-zero lattice spacings. N=1 SYM is an ideal benchmark toward the extension of our studies to more complex supersymmetric theories, as the only parameter to be tuned is the gluino mass. Overlap fermions allow therefore to simulate the theory without fine-tuning. We compare our approach to previous investigations of the same theory, and we present clear evidences for gluino condensation.
We study the improvement of simulations of QCD with dynamical Wilson fermions by combining the Hybrid Monte Carlo algorithm with parallel tempering. As an indicator for decorrelation we use the topological charge.
We present a polynomial hybrid Monte Carlo (PHMC) algorithm for lattice QCD with odd numbers of flavors of O(a)-improved Wilson quark action. The algorithm makes use of the non-Hermitian Chebyshev polynomial to approximate the inverse square root of the fermion matrix required for an odd number of flavors. The systematic error from the polynomial approximation is removed by a noisy Metropolis test for which a new method is developed. Investigating the property of our PHMC algorithm in the N_f=2 QCD case, we find that it is as efficient as the conventional HMC algorithm for a moderately large lattice size (16^3 times 48) with intermediate quark masses (m_{PS}/m_V ~ 0.7-0.8). We test our odd-flavor algorithm through extensive simulations of two-flavor QCD treated as an N_f = 1+1 system, and comparing the results with those of the established algorithms for N_f=2 QCD. These tests establish that our PHMC algorithm works on a moderately large lattice size with intermediate quark masses (16^3 times 48, m_{PS}/m_V ~ 0.7-0.8). Finally we experiment with the (2+1)-flavor QCD simulation on small lattices (4^3 times 8 and 8^3 times 16), and confirm the agreement of our results with those obtained with the R algorithm and extrapolated to a zero molecular dynamics step size.
UKQCDs dynamical fermion project uses the Generalised Hybrid Monte-Carlo (GHMC) algorithm to generate QCD gauge configurations for a non-perturbatively O(a) improved Wilson action with two degenerate sea-quark flavours. We describe our implementation of the algorithm on the Cray-T3E, concentrating on issues arising from code verification and performance optimisation, such as parameter tuning, reversibility, the effect of precision, the choice of matrix inverter and the behaviour of different molecular dynamics integration schemes.
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