Erratum: “Accelerating atomic-level protein simulations by flat-histogram techniques” [J. Chem. Phys. 135, 125102 (2011)]

Erratum: "Virial coefficients and demixing in the Asakura-Oosawa model" [J. Chem. Phys. 142, 014902 (2015)].

Response to “Comment on ‘Accurate frozen-density embedding potentials as a first step towards a subsystem description of covalent bonds’” [J. Chem. Phys. 135, 027101 (2011)]

Response to “Comment on ‘Accurate frozen-density embedding potentials as a first step towards a subsystem description of covalent bonds’” [J. Chem. Phys. 135, 027101 (2011)] Samuel Fux,1 Christoph R. Jacob,2,a) Johannes Neugebauer,3,b) Lucas Visscher,4 and Markus Reiher1 1Laboratorium für Physikalische Chemie, ETH Zurich, Wolfgang-Pauli-Strasse 10, 8093 Zurich, Switzerland 2Center for Functiona...

Level of Detail Techniques for Accelerating Crowd Simulations

In this work we apply level of detail techniques to scale up the number of agents in realtime crowd simulations. Level of detail techniques are most studied with respect to geometric simplifications for rendering, but similar ideas are used here for computational simplification for simulations. In particular, we studied methods for computing the paths of agents in a crowd. The main approach for...

Erratum: "Multi-reference approach to the calculation of photoelectron spectra including spin-orbit coupling" [J. Chem. Phys. 143, 074104 (2015)].

Revised for J. Phys. Chem. B on August 11, 2006 Phase Behavior of Elemental Aluminum using Monte Carlo Simulations

Monte Carlo simulations are presented for two models of aluminum, an embeddedatom model and an explicit many-body model. Vapor/liquid coexistence curves are determined using Gibbs ensemble Monte Carlo simulations. The normal boiling points predicted by both models are somewhat higher (by about 10%) than the experimental value. Isothermal constant-stress simulations are used to simulate solid Al...