73 citations · 103 across the 2 of their papers we have counts for
2 papers
cond-mat.stat-mech2010★ 30 cited
Path integral Monte Carlo simulations for rigid rotors and their application to water
Eva G. Noya, Luis M. Sesé, Rafael Ramírez +3
In this work the path integral formulation for rigid rotors, proposed by Müser and Berne [Phys. Rev. Lett. {\bf 77}, 2638 (1996)], is described in detail. It is shown how this form…
cond-mat.stat-mech2009★ 73 cited
Quantum contributions in the ice phases: the path to a new empirical model for water -- TIP4PQ/2005
Carl McBride, Carlos Vega, Eva G. Noya +2
With a view to a better understanding of the influence of atomic quantum delocalisation effects on the phase behaviour of water, path integral simulations have been undertaken for…