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Contribution List

Displaying 28 contributions out of 28
Session: CLOSING SESSION
Session: Chemistry below 1 K: Observation of the smallest droplet of acid
Session: Competing quantum effects in liquid water
Session: Concerted proton tunnelling in ordinary ice
Session: Dynamics of proton transfer in biological systems
Session: Effect of proton disorder in the excited state properties of ice
Session: H-bonded Ferroelectrics from first-principles and derived modeling
Session: High pressure structural studies of hydrogen bond centring
Session: Hydrogen-bonding in bi-component supramolecular nanoporous networks
Session: Ice and Victoria Buch: a cold surface and a warm heart
Session: Is ambient water homogeneous or inhomogeneous?
Session: Molecular solvents over heterogeneous surfaces and ionic liquids in the bulk - experimental and theoretical study of hydrogen bonding systems
Session: Nuclear quantum effects in water: a study in position and momentum space
Session: OPENING SESSION
Session: On the accuracy of density-functional theory exchange-correlation functionals for hydrogen bonds in water
Session: POSTER SESSION
Session: Proton dynamics in short hydrogen bonds: two-site hopping in a single-well potential
Session: Proton momentum distribution of water confined in nanopores, protein hydration shells and DNA
Session: Proton quantum effects in water
Session: Quantization of vibrations in H-bonded crystals
Session: Secondary structure of H-bonded Polyalanine peptides in vacuo: Computational spectroscopy and DFT
Session: Simulations of water and artificial liquids with weakened hydrogen bonds
Session: Strong anharmonicity and isotope effects in Cr00H/Cr00D
Session: Study of mobile protons in enzymes as revealed by subatomic x-ray and neutron diffraction experiments
Session: The aqueous liquid-vapor interface: new insights from a novel Car-Parrinello-like approach to Born-Oppenheimer molecular dynamics
Session: The evolution of hydrogen bonds in molecular materials under changing external conditions by neutron diffraction and complementary methods
Session: The quantum nature of the proton in water-hydroxyl overlayers on metal surfaces
Session: Water adsorption on 0/Ru(0001): Dissociation and cooperative effects

Organizers

Directors: J. Kohanoff, S. Koval, R. Senesi Local Organizer: E. Tosatti