David C. Clary

发表

Quantum stereodynamics of four-atom reactions: theory and application to H2+OH↔H2O+H

Marcelo P. de Miranda, Sergei K. Pogrebnya, David C. Clary, 1999 .

EARLY LIFE AND CAREER

Peter J. Knowles, David J. Tozer, David C. Clary, 2000, Beria.

Computational molecular spectroscopy

Frank Neese, Vincenzo Barone, David C. Clary, 2021, Nature Reviews Methods Primers.

Ultra‐low temperature kinetics of neutral–neutral reactions: New experimental and theoretical results for OH+HBr between 295 and 23 K

David C. Clary, Ian W. M. Smith, D. Clary, 1994 .

Quantum dynamics of the O(3P)+CH4→CH3+OH reaction

David C. Clary, D. Clary, 1999 .

Mode selective chemistry in the reactions of OH with HBr and HCl

David C. Clary, G. Nyman, D. Clary, 1994 .

Quantum Chemistry of Complex Systems

David C. Clary, D. Clary, 2006, Science.

Product CN Rotational Distributions from the H + HCN Reaction

David C. Clary, 1995 .

Quantum scattering and quasi-classical trajectory calculations for the H2+OH⇌H2O+H reaction on a new potential surface

Juliana Palma, Sergei K. Pogrebnya, David C. Clary, 2000 .

Potential optimized discrete variable representation

David C. Clary, Julián Echave, D. Clary, 1992 .

Quantum reactive scattering of four‐atom reactions with nonlinear geometry: OH+H2→H2O+H

David C. Clary, D. Clary, 1991 .

Quantum and quasiclassical calculations on the OH+CO→CO2+H reaction

George C. Schatz, David C. Clary, G. Schatz, 1993 .

The dynamics of the reaction OH + D2 → HOD + D: Crossed beam experiments and quantum mechanical scattering calculations on ab initio potential energy surfaces

Nadia Balucani, Hans-Joachim Werner, David C. Clary, 1996 .

Application of hyperspherical coordinates to four‐atom reactive scattering: H2+CN→H+HCN

David C. Clary, D. Clary, A. Brooks, 1990 .

Quantum scattering calculations on H2O+H→H2+OH and isotopes: Rotational distributions and cross sections

David C. Clary, G. Nyman, D. Clary, 1993 .

Refinement of the OH A 2Σ+(v=0)+Ar intermolecular potential energy surface

Marsha I. Lester, Charusita Chakravarty, David C. Clary, 1993 .

Definition of the hydrogen bond (IUPAC Recommendations 2011)

David J. Nesbitt, Pavel Hobza, Gautam R. Desiraju, 2011 .

Defining the hydrogen bond: An account (IUPAC Technical Report)

David J. Nesbitt, Pavel Hobza, Gautam R. Desiraju, 2011 .

A study of HOCO resonances in the OH+CO→CO2+H reaction

David C. Clary, Marta I. Hernández, D. Clary, 1994 .

New Potential Energy Function for Four-Atom Reactions. Application to OH + H2

David C. Clary, Guillermo Ochoa de Aspuru and, 1998 .

Computational studies of protein–peptide interactions with systematic mutation of residues

David C. Clary, D. Clary, Dominic F. Clare, 2004 .

Zero temperature quantum properties of small protonated water clusters (H2O)nH+ (n=1–5)

David C. Clary, D. Clary, M. Mella, 2003 .