His primary scientific interests are in Ab initio, Atomic physics, Computational chemistry, Basis set and Molecule. His Ab initio research is multidisciplinary, relying on both Crystallography, Bond length, Force field and Ab initio quantum chemistry methods. His research in Atomic physics intersects with topics in Spectral line, Electronic structure, Microwave and Absorption spectroscopy.
His Computational chemistry study combines topics in areas such as Molecular physics, Steric effects, Resonance and Ring. His studies in Basis set integrate themes in fields like Electronic correlation, Dipole, Valence electron, Polarization and Molecular geometry. His work deals with themes such as Basis function and Photochemistry, which intersect with Molecule.
His primary areas of study are Ab initio, Computational chemistry, Molecule, Atomic physics and Basis set. His research integrates issues of Bond length, Ab initio quantum chemistry methods, Crystallography, Force field and Molecular physics in his study of Ab initio. His Computational chemistry research is multidisciplinary, incorporating elements of Gaussian orbital, Steric effects, Bond order, Ring and Double bond.
His research in Molecule tackles topics such as Electron diffraction which are related to areas like Rotational spectroscopy. His Atomic physics research includes elements of Dipole, Coupled cluster and Microwave. The concepts of his Basis set study are interwoven with issues in Electronic correlation and Anharmonicity.
James E. Boggs mainly investigates Atomic physics, Ab initio, Ab initio quantum chemistry methods, Ground state and Molecule. His Atomic physics research incorporates elements of Spectral line, Dipole, Coupled cluster and Spin–orbit interaction. The study incorporates disciplines such as Force field, Valence, Molecular physics, Basis set and Computational chemistry in addition to Ab initio.
He has included themes like Thermochemistry, Eigenfunction, Hamiltonian, Anharmonicity and Molecular geometry in his Basis set study. His study in Ab initio quantum chemistry methods is interdisciplinary in nature, drawing from both Electronic structure, Potential energy and Distortion. His Molecule research incorporates elements of Symmetry and Bent molecular geometry.
His primary areas of investigation include Ab initio quantum chemistry methods, Atomic physics, Molecule, Computational chemistry and Ab initio. His Ab initio quantum chemistry methods research includes elements of Jahn–Teller effect, Excited state, Electronic structure and Fluorine. His Atomic physics study incorporates themes from Atomic radius and Scalar.
The various areas that James E. Boggs examines in his Molecule study include Crystallography, Spectroscopy and Molecular physics. His biological study spans a wide range of topics, including Pharmacophore, Bond order, Molecular model and Difluorocarbene. His work deals with themes such as Bond length, Basis set and Hamiltonian, which intersect with Ab initio.
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Systematic AB Initio Gradient Calculation of Molecular Geometries, Force Constants, and Dipole Moment Derivatives
P. Pulay;G. Fogarasi;F. Pang;J. E. Boggs.
Journal of the American Chemical Society (1979)
Combination of theoretical ab initio and experimental information to obtain reliable harmonic force constants. Scaled quantum mechanical (QM) force fields for glyoxal, acrolein, butadiene, formaldehyde, and ethylene
Peter Pulay;Geza Fogarasi;Gabor Pongor;James E. Boggs.
Journal of the American Chemical Society (1983)
Force field, dipole moment derivatives, and vibronic constants of benzene from a combination of experimental and ab initio quantum chemical information
P. Pulay;G. Fogarasi;J. E. Boggs.
Journal of Chemical Physics (1981)
IUPAC Critical Evaluation of Thermochemical Properties of Selected Radicals. Part I
Branko Ruscic;James E. Boggs;Alexander Burcat;Attila G. Császár.
Journal of Physical and Chemical Reference Data (2005)
Cubic force constants and equilibrium geometry of methane from Hartree–Fock and correlated wavefunctions
Péter Pulay;Wilfried Meyer;James E. Boggs.
Journal of Chemical Physics (1978)
Collision Broadening of Rotational Absorption Lines. I. Theoretical Formulation
Joseph S. Murphy;James E. Boggs.
Journal of Chemical Physics (1967)
Theoretical prediction of vibrational spectra. 2. Force field, spectroscopically refined geometry, and reassignment of the vibrational spectrum of naphthalene
Harrell Sellers;Peter Pulay;James E. Boggs.
Journal of the American Chemical Society (1985)
Theoretical Prediction of Vibrational Spectra. 1. The In-Plane Force Field and Vibrational Spectra of Pyridine
G. Pongor;P. Pulay;G. Fogarasi;J. E. Boggs.
Journal of the American Chemical Society (1984)
Importance of (p-d).pi. bonding in the siloxane bond
Heinz Oberhammer;James E. Boggs.
Journal of the American Chemical Society (1980)
A systematic study of the convergence and additivity of correlation and basis set effects on the force constants of small molecules: HF, HCN, and NH3
Péter Pulay;Jung‐Goo Lee;James E. Boggs.
Journal of Chemical Physics (1983)
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