Chemical Physics May 2006 (2024)

Title: Dual-Topology Hamiltonian-Replica-Exchange Overlap Histogramming Method to Calculate Relative Free Energy Difference in Rough Energy Landscape

Comments: 14 pages with 4 figures

Journal-ref: J. Chem. Phys. 126, 144109 (2007)

Subjects: Chemical Physics (physics.chem-ph)

Title: Scaling relations, virial theorem and energy densities for long-range and short-range density functionals

Comments: 7 pages, 3 figures

Journal-ref: Int. J. Quantum Chem. 106, 2026 (2006)

Subjects: Chemical Physics (physics.chem-ph)

Title: Local density approximation for long-range or for short-range energy functionals?

Comments: 4 pages, 2 figures, to appear in J. Mol. Struct. (Theochem)

Journal-ref: J. Mol. Struct. (Theochem) 762, 147 (2006)

Subjects: Chemical Physics (physics.chem-ph)

Title: Field-induced phases of an orientable charged particle in a dilute background of point charges

Comments: 10 pages, 3 figures

Subjects: Chemical Physics (physics.chem-ph); Plasma Physics (physics.plasm-ph)

Title: Quantum mechanical and quasiclassical investigation of the time domain nonadiabatic dynamics of NO2 close to the bottom of the X2A1-A2B2 conical intersection

Comments: accepted for publication in J. Chem. Phys

Journal-ref: Journal of Chemical Physics, 125 (2006) 014304

Subjects: Chemical Physics (physics.chem-ph)

Title: Model of molecular bonding based on the Bohr-Sommerfeld picture of atoms

Comments: 5 pages, 7 figures, to appear in Physics Letters A

Journal-ref: Physics Letters A, v. 355, pp. 373-377 (2006)

Subjects: Chemical Physics (physics.chem-ph)

Title: Rotational Energy Transfer in H2+H2

Comments: 4 Figures, 1 Table

Subjects: Chemical Physics (physics.chem-ph); Atomic and Molecular Clusters (physics.atm-clus)

Title: A water film motor

Comments: 3 pages, 3 figures. Related movies are avialable at this http URL

Subjects: Soft Condensed Matter (cond-mat.soft); Chemical Physics (physics.chem-ph); Fluid Dynamics (physics.flu-dyn)

Title: Model hamiltonians in density functional theory

Comments: to appear as a contribution for "High-dimensional Partial Differential Equations in Science and Engineering", CRM series

Journal-ref: in "High-dimensional Partial Differential Equations in Science and Engineering", CRM Proceedings and Lecture Notes 41, 117 (2007)

Subjects: Materials Science (cond-mat.mtrl-sci); Chemical Physics (physics.chem-ph)

Title: Analytical First Derivatives of the RE-squared Interaction Potential

Subjects: Soft Condensed Matter (cond-mat.soft); Chemical Physics (physics.chem-ph); Biomolecules (q-bio.BM)

Title: How `sticky' are short-range square-well fluids?

Comments: 14 pages, including 3 tables and 14 figures; v2: typo in Eq. (5.1) corrected, Fig. 14 redone, to be published in JCP

Journal-ref: J. Chem. Phys. 125, 074507 (2006)

Subjects: Statistical Mechanics (cond-mat.stat-mech); Soft Condensed Matter (cond-mat.soft); Chemical Physics (physics.chem-ph)

Title: New Cyclic Voltammetry Method for Examining Phase Transitions: Simulated Results

Comments: 18 pages, 7 figures, accepted for publication in Journal of Electroanalytical Chemistry, changes in title, abstract and figures

Journal-ref: Journal of Electroanalytical Chemistry 607 (2007) 61--68

Subjects: Materials Science (cond-mat.mtrl-sci); Chemical Physics (physics.chem-ph)

Title: Photodetachment of H$^{-}$ by a Short Laser Pulse in Crossed Static Electric and Magnetic Fields

Comments: Submitted to Physical Review A

Journal-ref: Phys. Rev. A 74, 023402 (2006) (20 pages)

Subjects: Atomic Physics (physics.atom-ph); Chemical Physics (physics.chem-ph)

Title: Toward the Stable Optical Trapping of a Droplet with Counter Laser Beams under Microgravity

Subjects: Optics (physics.optics); Chemical Physics (physics.chem-ph)

Title: Pushing the hyperpolarizability to the limit

Comments: 4 pages, 3 figures

Journal-ref: Opt. Lett. 31, 2891-2893(2006)

Subjects: Optics (physics.optics); Chemical Physics (physics.chem-ph)

Title: Coulomb oscillation in the hydrogen atom and molecule ion

Comments: 20 text pages, 10 separate figures (Revised to embed figures)

Subjects: History and Philosophy of Physics (physics.hist-ph); Chemical Physics (physics.chem-ph)

Title: Effective affinities in microarray data

Comments: 8 pages, 6 figures

Journal-ref: J. Phys.: Condens. Matter 18, S525(2006)

Subjects: Biomolecules (q-bio.BM); Soft Condensed Matter (cond-mat.soft); Chemical Physics (physics.chem-ph)

Title: Physics-based analysis of Affymetrix microarray data

Comments: 11 pages, 10 figures

Journal-ref: J. Phys. Chem. B 110, 22786 (2006)

Subjects: Biomolecules (q-bio.BM); Statistical Mechanics (cond-mat.stat-mech); Chemical Physics (physics.chem-ph)