2009

V. Bitrian, O. Alcaraz , J. Trullàs,
Static dielectric properties of polarizable ion models: Molecular dynamics study of molten AgI and NaI
Journal of Chemical Physics 130, 234504/1-10 (2009)

E. Guàrdia, I. Skarmoutsos, M. Masia

On ion and molecular polarization of halides in water
J. Chem. Theory Comput. 5, 1449-1453 (2009)

 

I. Skarmoutsos, E. Guàrdia
Local structural effects and related dynamics in supercritical ethanol. 2. Hydrogen bonding network and its effect on single reorientational dynamics

Journal of Physical Chemistry B 113, 8898-8910 (2009)

 

I. Skarmoutsos, E. Guàrdia
Local structural effects and related dynamics in supercritical ethanol. 1. Mechanisms of local density reorganization and residence dynamics
Journal of Physical Chemistry B 113, 8887-8897 (2009)

 

J. Martí, J. Sala, E. Guàrdia, M. C. Gordillo
Molecular dynamics simulations of supercritical water confined within a carbon-slit pore
Physical Review E 79, 031606/1-10 (2009)

 

J. Rodriguez, J. Martí, E. Guàrdia, D. Laria
Dynamics of water nanodroplets and aqueous protons in non-ionic reverse micelles
Phys. Chem. Chem. Phys. 11, 1484-1490 (2009)

 

R. Rey, F. Ingrosso, T. Elsaesser, J.T. Hynes
Pathways for H2O bend vibrational relaxation in liquid water
Journal of Physical Chemistry A 113, 8949-8962 (2009)

 

F. Ingrosso, R. Rey, T. Elsaesser, J.T. Hynes
Ultrafast energy transfer from the intramolecular bending vibration to librations in liquid water
Journal of Physical Chemistry A 113, 6657-6665 (2009)

 

R. Rey
Is there a common orientational order for the liquid phase of tetrahedral molecules?
Journal of Chemical Physics 131, 64502 (2009)

J. Casanovas, M. Canales, C. A. Ferreira, C. Alemán

A First Principle Analysis of the Structure of Oligoanilines Doped with Alkylsulfonic Acids

Journal of Physical Chemistry A 113,8795-8800 (2009)

 

M. Canales

Influence of the torsional potential on the glass transition temperature and the structure of amorphous polyethylene

Physical Review E 79, 051802/1-10 (2009) F. Rodriguez-Ropero,

 

M. Canales, D. Zanuy, D, A. Zhang, D. Schlüter, C. Alemán

Helical Dendronized Polymers with Chiral Second-Generation Dendrons: Atomistic View and Driving Forces for Structure Formation

Journal of Physical Chemistry B 113, 14868-14876 (2009)

 

E. Guàrdia , I. Skarmoutsos, M. Masia
On ion and molecular polarization of halides in water
Journal of Chemical Theory and Computation 5, 1449-1453 (2009)

J. Rodriguez, D. Laria, E. Guàrdia, J.Martí
Dynamics of water nanodroplets and aqueous protons in non-ionic reverse micelles
Physical Chemistry Chemical Physics 11, 1484 - 1490 (2009)

M. Saarela, F. Mazzanti,
Dynamic Structure Function  of quantum Bose systems; condensate fraction and momentum distribution,
Cond. Matt. Theor. 23, 4327 (2009)

I. Beslic, L. Vranjes Markic, J. Boronat,
Quantum Monte Carlo study of  large spin-polarized tritium clusters,
Journal of Chemical Physics 131, 244506  (2009) 

I. Beslic, L. Vranjes Markic, J. Boronat,
Quantum Monte Carlo simulation of spin-polarized tritium,
Phys. Rev. B 80, 134506 (2009) 

I. Beslic, L. Vranjes Markic,  J. Boronat,
Stability limits of mixed spin-polarised tritium clusters,
Journal of  Physics: Conference Series 150, 032010 (2009) 

G. E Astrakharchik, G. De Chiara, G. Morigi, J. Boronat
Thermal and quantum fluctuations in chains of ultracold polar molecules
Journal of Physics B 42, 154026/1-13 (2009)

G. E. Astrakharchik, J. Boronat, J. Casulleras, I. L. Kurbakov, Y. E. Lozovik
Equation of state of a weakly interacting two-dimensional Bose gas studied at zero temperature by means of quantum Monte Carlo methods
Physical Review A 79, 051602/1-4 (2009)

C. Cazorla , G. E. Astrakharchik, J. Casulleras, J. Boronat
Bose-Einstein quantum statistics and the ground state of solid He⁴
New Journal of Physics 11, 013047/1-10 (2009)

M. C. Gordillo, J. Boronat
He⁴ on a Single Graphene Sheet
Physical Review Letters 102, 085303/1-4 (2009)

F. Mazzanti , R. E. Zillich, G. E. Astrakharchik, J. Boronat
Dynamics of a Two-Dimensional System of Quantum Dipoles
Physical Review Letters 102, 110405/1-4 (2009)

K. Sakkos, J. Casulleras, J. Boronat
High order Chin actions in path integral Monte Carlo
Journal of Chemical Physics 130, 204109/1-10 (2009)

X. Castello, A. Baronchelli, V. Loreto

Consensus and ordering in language dynamics
European Physical Journal B 71, 557-564 (2009)

 

C. Castellano, M. A. Muñoz,, R. Pastor-Satorras
Non-linear q-voter model
Physical Review E 80, 041129/1-9 (2009).

A. Baronchelli, A. Barrat, R. Pastor-Satorras
Glass transition and random walks on complex energy landscapes
Physical Review E 80, 020102/1-4 (2009)

M. Boguñá , C. Castellano, R. Pastor-Satorras
Langevin approach for the dynamics of the contact process on annealed scale-free networks
Physical Review E 79, 036110/1-17 (2009)