D-Index & Metrics Best Publications

D-Index & Metrics D-index (Discipline H-index) only includes papers and citation values for an examined discipline in contrast to General H-index which accounts for publications across all disciplines.

Discipline name D-index D-index (Discipline H-index) only includes papers and citation values for an examined discipline in contrast to General H-index which accounts for publications across all disciplines. Citations Publications World Ranking National Ranking
Chemistry D-index 58 Citations 12,603 308 World Ranking 7166 National Ranking 409

Overview

What is he best known for?

The fields of study he is best known for:

  • Organic chemistry
  • Catalysis
  • Molecule

His scientific interests lie mostly in Computational chemistry, Chemical shift, Physical chemistry, Crystallography and Molecule. His specific area of interest is Computational chemistry, where he studies Density functional theory. His research integrates issues of Fullerene, Helium, Atomic physics, Ab initio and Nuclear magnetic resonance spectroscopy in his study of Chemical shift.

His studies in Physical chemistry integrate themes in fields like Uranyl, Solvent, Molecular dynamics, Fluorine-19 NMR and Electron paramagnetic resonance. His work deals with themes such as Stereochemistry and Phosphine, which intersect with Crystallography. His Molecule research is multidisciplinary, incorporating perspectives in Inorganic chemistry and Analytical chemistry.

His most cited work include:

  • Calculation of NMR and EPR parameters : theory and applications (591 citations)
  • Geometries of Transition-Metal Complexes from Density-Functional Theory (434 citations)
  • Spherical aromaticity of fullerenes. (356 citations)

What are the main themes of his work throughout his whole career to date?

The scientist’s investigation covers issues in Computational chemistry, Crystallography, Chemical shift, Density functional theory and Stereochemistry. The Computational chemistry study which covers Transition metal that intersects with Metal. His work carried out in the field of Crystallography brings together such families of science as Conformational isomerism, Molecule, Electron diffraction and Ab initio.

His study in Chemical shift is interdisciplinary in nature, drawing from both Fullerene, Nuclear magnetic resonance spectroscopy, Substituent and Analytical chemistry. The study incorporates disciplines such as Ligand and Coupling constant in addition to Density functional theory. His study looks at the relationship between Stereochemistry and topics such as Medicinal chemistry, which overlap with Catalysis and Palladium.

He most often published in these fields:

  • Computational chemistry (32.34%)
  • Crystallography (30.36%)
  • Chemical shift (25.41%)

What were the highlights of his more recent work (between 2014-2020)?

  • Crystallography (30.36%)
  • Stereochemistry (17.82%)
  • Catalysis (9.90%)

In recent papers he was focusing on the following fields of study:

Michael Bühl mainly focuses on Crystallography, Stereochemistry, Catalysis, Density functional theory and Organic chemistry. Michael Bühl interconnects Infrared, Nuclear magnetic resonance spectroscopy, Spin and Organofluorine chemistry in the investigation of issues within Crystallography. His Stereochemistry research includes themes of Conformational isomerism, Trifluoromethyl, Deprotonation and Hydrogen bond.

The Catalysis study combines topics in areas such as Ligand and Medicinal chemistry. His Density functional theory study is concerned with the larger field of Computational chemistry. The Computational chemistry study combines topics in areas such as Electrostatics, Helicity and Kinetic control.

Between 2014 and 2020, his most popular works were:

  • Uncovering the Mechanism of Homogeneous Methyl Methacrylate Formation with P,N Chelating Ligands and Palladium: Favored Reaction Channels and Selectivities (32 citations)
  • Understanding a Hydroformylation Catalyst that Produces Branched Aldehydes from Alkyl Alkenes (20 citations)
  • Peri-substituted phosphorus-tellurium systems – an experimental and theoretical investigation of the P∙∙∙Te through-space interaction (19 citations)

In his most recent research, the most cited papers focused on:

  • Organic chemistry
  • Catalysis
  • Quantum mechanics

Stereochemistry, Crystallography, Nuclear magnetic resonance spectroscopy, Organic chemistry and Computational chemistry are his primary areas of study. His research in the fields of Cyclopentane overlaps with other disciplines such as Angelica archangelica. In his study, Moiety and Spin label is strongly linked to Spin, which falls under the umbrella field of Crystallography.

He focuses mostly in the field of Nuclear magnetic resonance spectroscopy, narrowing it down to topics relating to Tellurium and, in certain cases, Coupling and X-ray crystallography. The Iridium, Decarboxylation and Quinoline research Michael Bühl does as part of his general Organic chemistry study is frequently linked to other disciplines of science, such as Mechanism, therefore creating a link between diverse domains of science. In his study, he carries out multidisciplinary Computational chemistry and N alkanes research.

This overview was generated by a machine learning system which analysed the scientist’s body of work. If you have any feedback, you can contact us here.

Best Publications

Calculation of NMR and EPR parameters : theory and applications

Martin Kaupp;Michael Bühl;Vladimir G. Malkin.
(2004)

818 Citations

Spherical aromaticity of fullerenes.

Michael Bühl;Andreas Hirsch.
Chemical Reviews (2001)

619 Citations

Geometries of Transition-Metal Complexes from Density-Functional Theory

Michael Bühl;Hendrik Kabrede.
Journal of Chemical Theory and Computation (2006)

604 Citations

Geometries of Third-Row Transition-Metal Complexes from Density-Functional Theory.

Michael Bühl;Christoph Reimann;Dimitrios A. Pantazis;Thomas Bredow.
Journal of Chemical Theory and Computation (2007)

447 Citations

Synthesis, structure, theoretical studies, and Ligand exchange reactions of monomeric, T-shaped arylpalladium(II) halide complexes with an additional, weak agostic interaction

James P Stambuli;Christopher D Incarvito;Michael Bühl;John F Hartwig.
Journal of the American Chemical Society (2004)

337 Citations

Synthesis, characterization, and reactivity of monomeric, arylpalladium halide complexes with a hindered phosphine as the only dative ligand

James P. Stambuli;Michael Bühl;John F. Hartwig.
Journal of the American Chemical Society (2002)

336 Citations

The DFT route to NMR chemical shifts

Michael Bühl;Martin Kaupp;Olga L. Malkina;Vladimir G. Malkin.
Journal of Computational Chemistry (1999)

326 Citations

Ab initio molecular dynamics of liquid 1,3-dimethylimidazolium chloride.

Michael Bühl;Alain Chaumont;Rachel Schurhammer;Georges Wipff.
Journal of Physical Chemistry B (2005)

229 Citations

Mechanism of olefin metathesis with catalysis by ruthenium carbene complexes: density functional studies on model systems.

Sergei F. Vyboishchikov;Michael Bühl;Walter Thiel.
Chemistry: A European Journal (2002)

227 Citations

Hydrogen generation from alcohols catalyzed by ruthenium-triphenylphosphine complexes: multiple reaction pathways.

Nicolas Sieffert;Michael Bühl.
Journal of the American Chemical Society (2010)

214 Citations

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