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Wesley D. Allen | doi.page

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Wesley D. Allen

Publications by Year

Research Areas

Advanced Chemical Physics Studies, Spectroscopy and Quantum Chemical Studies, Molecular Spectroscopy and Structure, Atmospheric Ozone and Climate, Atmospheric chemistry and aerosols

Most-Cited Works

→ Psi4: an open‐source ab initio electronic structure program(2011)1,053 cited
→ In pursuit of the ab initio limit for conformational energy prototypes(1998)709 cited
→ A Hierarchy of Homodesmotic Reactions for Thermochemistry(2009)599 cited
→ The C₂H₅ + O₂ Reaction Mechanism: High-Level ab Initio Characterizations(2000)553 cited
→ A systematic study of molecular vibrational anharmonicity and vibration—rotation interaction by self-consistent-field higher-derivative methods. Asymmetric top molecules(1988)483 cited
→ The heat of formation of NCO(1993)396 cited

→ Methylhydroxycarbene: Tunneling Control of a Chemical Reaction(2011)

363 cited

→ Toward subchemical accuracy in computational thermochemistry: Focal point analysis of the heat of formation of NCO and [H,N,C,O] isomers(2004)338 cited

→ A systematic study of molecular vibrational anharmonicity and vibration-rotation interaction by self-consistent-field higher-derivative methods. Linear polyatomic molecules(1990)319 cited

→ Capture of hydroxymethylene and its fast disappearance through tunnelling(2008)292 cited