What is he best known for?
The fields of study he is best known for:
- Quantum mechanics
- Organic chemistry
- Molecule
Pavel Hobza spends much of his time researching Computational chemistry, Ab initio, Hydrogen bond, Basis set and Crystallography.
His work carried out in the field of Computational chemistry brings together such families of science as Basis, Non-covalent interactions, Stacking and Interaction energy.
His studies deal with areas such as Nucleobase, Molecule, Ab initio quantum chemistry methods, Dimer and Tautomer as well as Ab initio.
His Hydrogen bond research focuses on subjects like Spectroscopy, which are linked to Biomolecule.
His Basis set research includes themes of Potential energy, Binding energy, Atomic orbital and Benchmark data.
Pavel Hobza has researched Crystallography in several fields, including Cytosine, Base pair, Chemical bond and Bond energy.
His most cited work include:
- Functionalization of Graphene: Covalent and Non-Covalent Approaches, Derivatives and Applications (2576 citations)
- Benchmark database of accurate (MP2 and CCSD(T) complete basis set limit) interaction energies of small model complexes, DNA base pairs, and amino acid pairs. (1369 citations)
- Blue-Shifting Hydrogen Bonds. (1332 citations)
What are the main themes of his work throughout his whole career to date?
His scientific interests lie mostly in Computational chemistry, Ab initio, Crystallography, Hydrogen bond and Molecule.
His Computational chemistry research is multidisciplinary, relying on both Non-covalent interactions, Electronic correlation, Interaction energy and Ab initio quantum chemistry methods.
His Ab initio research is multidisciplinary, incorporating elements of Molecular physics, Intermolecular force, Atomic physics and Molecular dynamics.
His Crystallography research includes elements of Thymine, Base pair, Dispersion and Dimer.
The Hydrogen bond study combines topics in areas such as Quantum chemical, Physical chemistry, Natural bond orbital, Stacking and Binding energy.
His research integrates issues of Stereochemistry and Tautomer in his study of Molecule.
He most often published in these fields:
- Computational chemistry (46.73%)
- Ab initio (25.49%)
- Crystallography (27.12%)
What were the highlights of his more recent work (between 2013-2021)?
- Crystallography (27.12%)
- Non-covalent interactions (16.50%)
- Computational chemistry (46.73%)
In recent papers he was focusing on the following fields of study:
His main research concerns Crystallography, Non-covalent interactions, Computational chemistry, Molecule and Chemical physics.
His Crystallography study integrates concerns from other disciplines, such as Covalent bond, Dispersion, Halogen bond and Molecular dynamics.
His Non-covalent interactions study combines topics from a wide range of disciplines, such as Halogen, Cluster, Statistical physics, van der Waals force and Density functional theory.
Pavel Hobza focuses mostly in the field of Statistical physics, narrowing it down to matters related to Wave function and, in some cases, Interaction energy.
His Computational chemistry research incorporates themes from Solvation, Quantum, Hydrogen bond, Binding energy and Scaling.
His Hydrogen bond research is multidisciplinary, incorporating perspectives in Ab initio, Force field and Medicinal chemistry.
Between 2013 and 2021, his most popular works were:
- Computer Modeling of Halogen Bonds and Other σ-Hole Interactions (325 citations)
- Computer Modeling of Halogen Bonds and Other $\sigma$-Hole Interactions (292 citations)
- Benchmark Calculations of Interaction Energies in Noncovalent Complexes and Their Applications (185 citations)
In his most recent research, the most cited papers focused on:
- Quantum mechanics
- Organic chemistry
- Molecule
Computational chemistry, Halogen, Non-covalent interactions, Halogen bond and Stereochemistry are his primary areas of study.
The study incorporates disciplines such as Work, Interaction energy, Quantum, Statistical physics and Benchmark in addition to Computational chemistry.
Pavel Hobza interconnects Crystal structure, Hydrogen bond and Physical chemistry in the investigation of issues within Halogen.
His biological study spans a wide range of topics, including Chemical physics, Intermolecular force, Chemical bond, Affinities and van der Waals force.
His Halogen bond research integrates issues from Crystallography, Polar and Analytical chemistry.
His Crystallography research focuses on Dispersion and how it relates to Atom.
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