Quantum nature of the hydrogen bond

Communications: On artificial frequency shifts in infrared spectra obtained from centroid molecular dynamics: Quantum liquid water

(2010) Sergei D. Ivanov et al.   JOURNAL OF CHEMICAL PHYSICS

Estimating the Hydrogen Bond Energy

(2010) Katharina Wendler et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Tunneling in enzymatic and nonenzymatic hydrogen transfer reactions

(2010) Donald G. Truhlar   JOURNAL OF PHYSICAL ORGANIC CHEMISTRY

Quantum Nature of the Proton in Water-Hydroxyl Overlayers on Metal Surfaces

(2010) Xin-Zheng Li et al.   PHYSICAL REVIEW LETTERS

On the applicability of centroid and ring polymer path integral molecular dynamics for vibrational spectroscopy

(2009) Alexander Witt et al.   JOURNAL OF CHEMICAL PHYSICS

Tunneling and delocalization effects in hydrogen bonded systems: A study in position and momentum space

(2009) Joseph A. Morrone et al.   JOURNAL OF CHEMICAL PHYSICS

Competing quantum effects in the dynamics of a flexible water model

(2009) Scott Habershon et al.   JOURNAL OF CHEMICAL PHYSICS

Geometric Isotope Effect on the N2H7+ Cation and N2H5− Anion by Ab Initio Path Integral Molecular Dynamics Simulation

(2008) Hiroaki Ishibashi et al.   CHEMPHYSCHEM

The vibrational proton potential in bulk liquid water and ice

(2008) C. J. Burnham et al.   JOURNAL OF CHEMICAL PHYSICS

Nuclear Quantum Effects in Water

(2008) Joseph A. Morrone et al.   PHYSICAL REVIEW LETTERS