Simulation and understanding of atomic and molecular quantum crystals

C Cazorla, J Boronat - Reviews of Modern Physics, 2017‏ - APS
Quantum crystals abound in the whole range of solid-state species. Below a certain
threshold temperature the physical behavior of rare gases (He 4 and Ne), molecular solids …

Computational modelling of thermo-mechanical and transport properties of carbon nanotubes

H Rafii-Tabar - Physics Reports, 2004‏ - Elsevier
Over the recent years, numerical modelling and computer-based simulation of the properties
of carbon nanotubes have become the focal points of research in computational nano …

[كتاب][B] The theory of intermolecular forces

A Stone - 2013‏ - books.google.com
The theory of intermolecular forces has advanced very greatly in recent years. It has become
possible to carry out accurate calculations of intermolecular forces for molecules of useful …

[كتاب][B] Structure and properties of atomic nanoclusters

JA Alonso - 2012‏ - books.google.com
Atomic clusters are aggregates of atoms containing a few to several thousand atoms. Due to
the small size of these pieces of matter, the properties of atomic clusters in general are …

Structure and dynamics of quantum clusters

KB Whaley - International Reviews in Physical Chemistry, 1994‏ - Taylor & Francis
Quantum clusters are van der Waals aggregates of light atomic and molecular species
whose behaviour is dominated by quantum delocalization and exchange effects. We …

Anisotropic dynamics of resonant scattering between a pair of cold aligned diatoms

H Zhou, WE Perreault, N Mukherjee, RN Zare - Nature Chemistry, 2022‏ - nature.com
The collision dynamics between a pair of aligned molecules in the presence of a partial-
wave resonance provide the most sensitive probe of the long-range anisotropic forces …

Theoretical collision-induced rototranslational absorption spectra for the outer planets-H2-CH4 pairs

A Borysow, L Frommhold - … Journal, Part 1 (ISSN 0004-637X) …, 1986‏ - adsabs.harvard.edu
Computations of the rototranslational absorption spectra of H 2-CH 4 molecular complexes
are presented which are based on the classical multipole expansion; spectral profiles are …

Structure, superfluidity, and quantum melting of hydrogen clusters

F Mezzacapo, M Boninsegni - Physical Review A—Atomic, Molecular, and …, 2007‏ - APS
We present results of a theoretical study of para-H 2 (pH 2) and ortho-D 2 (oD 2) clusters at
low temperature (0.5 K⩽ T⩽ 3.5 K) based on path integral Monte Carlo simulations. Clusters …

Interplay between theory and experiment in investigations of molecules embedded in superfluid helium nanodroplets

K Szalewicz - International Reviews in Physical Chemistry, 2008‏ - Taylor & Francis
Helium is the only substance that has been observed on macroscopic scale to form the
fourth state of matter, the superfluid state. However, until recently superfluid helium had not …

Microscopic molecular superfluid response: theory and simulations

T Zeng, PN Roy - Reports on Progress in Physics, 2014‏ - iopscience.iop.org
Since its discovery in 1938, superfluidity has been the subject of much investigation
because it provides a unique example of a macroscopic manifestation of quantum …