What is he best known for?
The fields of study he is best known for:
- Quantum mechanics
- Organic chemistry
- Molecule
His primary areas of investigation include Atomic physics, Configuration interaction, Computational chemistry, Ab initio and Electronic structure.
His Atomic physics study integrates concerns from other disciplines, such as Electronic correlation, Basis set and Ab initio quantum chemistry methods.
The study incorporates disciplines such as Molecular physics, Potential energy, Excitation, Coupled cluster and Ground state in addition to Configuration interaction.
While the research belongs to areas of Molecular physics, Henry F. Schaefer spends his time largely on the problem of Molecule, intersecting his research to questions surrounding Crystallography.
Density functional theory is the focus of his Computational chemistry research.
He works mostly in the field of Electronic structure, limiting it down to topics relating to Singlet state and, in certain cases, Triplet state.
His most cited work include:
- Advances in methods and algorithms in a modern quantum chemistry program package (2148 citations)
- Methods of Electronic Structure Theory (1648 citations)
- Advances in molecular quantum chemistry contained in the Q-Chem 4 program package (1461 citations)
What are the main themes of his work throughout his whole career to date?
His scientific interests lie mostly in Computational chemistry, Atomic physics, Ab initio, Crystallography and Configuration interaction.
His Computational chemistry research focuses on subjects like Bond length, which are linked to Molecular geometry.
Henry F. Schaefer interconnects Electronic structure, Basis set and Coupled cluster in the investigation of issues within Atomic physics.
In his work, Infrared is strongly intertwined with Molecular physics, which is a subfield of Ab initio.
His Crystallography research integrates issues from Double bond, Photochemistry, Singlet state, Stereochemistry and Density functional theory.
His biological study spans a wide range of topics, including Dipole, Electronic correlation and Wave function.
He most often published in these fields:
- Computational chemistry (28.46%)
- Atomic physics (26.21%)
- Ab initio (25.31%)
What were the highlights of his more recent work (between 2010-2021)?
- Crystallography (22.44%)
- Computational chemistry (28.46%)
- Density functional theory (13.67%)
In recent papers he was focusing on the following fields of study:
His primary scientific interests are in Crystallography, Computational chemistry, Density functional theory, Molecule and Photochemistry.
His research integrates issues of Single bond, Ligand, Transition metal, Singlet state and Stereochemistry in his study of Crystallography.
Henry F. Schaefer has included themes like Benzene, Ab initio, Potential energy surface, Physical chemistry and Transition state in his Computational chemistry study.
Ab initio is closely attributed to Ab initio quantum chemistry methods in his study.
Wave function is closely connected to Coupled cluster in his research, which is encompassed under the umbrella topic of Potential energy surface.
His Molecule study combines topics from a wide range of disciplines, such as Anharmonicity and Atomic physics.
Between 2010 and 2021, his most popular works were:
- Advances in molecular quantum chemistry contained in the Q-Chem 4 program package (1461 citations)
- Psi4: an open-source ab initio electronic structure program (610 citations)
- Psi4 1.1: An Open-Source Electronic Structure Program Emphasizing Automation, Advanced Libraries, and Interoperability (533 citations)
In his most recent research, the most cited papers focused on:
- Organic chemistry
- Quantum mechanics
- Molecule
His main research concerns Computational chemistry, Density functional theory, Crystallography, Photochemistry and Stereochemistry.
His work deals with themes such as Potential energy surface, Physical chemistry, Molecular physics, Coupled cluster and Transition state, which intersect with Computational chemistry.
His Coupled cluster research incorporates themes from Python, Diatomic molecule, Excitation and Atomic physics.
Henry F. Schaefer combines subjects such as Ab initio quantum chemistry methods and Bond-dissociation energy with his study of Atomic physics.
Within one scientific family, Henry F. Schaefer focuses on topics pertaining to Singlet state under Density functional theory, and may sometimes address concerns connected to Ionization energy.
His Crystallography research is multidisciplinary, relying on both Hydrogen, Ligand and Natural bond orbital, Molecule, Hydrogen bond.
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