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Stephan Ehrlich | Researchclopedia

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Stephan Ehrlich

University of Bonn ORCID

23

Works

84,025

Citations

13

h-index

14

i10-index

Research Topics

Advanced Chemical Physics Studies Crystallography and molecular interactions X-ray Diffraction in Crystallography

Affiliations

University of Bonn2012–2017

University of Münster2010–2012

Center for Theoretical Physics2017–2017

Institute of Organic Chemistry2011–2011

Top Works

A consistent and accurate<i>ab initio</i>parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

Stefan Grimme,Jens Antony,et al.

201054,712 citations

Crystallization and Solubility Studies

Synthesis and Properties of Aromatic Compounds

Effect of the damping function in dispersion corrected density functional theory

Stefan Grimme,Stephan Ehrlich,et al.

201126,009 citations

A look at the density functional theory zoo with the advanced GMTKN55 database for general main group thermochemistry, kinetics and noncovalent interactions

Lars Goerigk,Andreas Hansen,et al.

20171,860 citations

System‐Dependent Dispersion Coefficients for the DFT‐D3 Treatment of Adsorption Processes on Ionic Surfaces

Stephan Ehrlich,Jonas Moellmann,et al.

2011467 citations

Dispersion-Corrected Density Functional Theory for Aromatic Interactions in Complex Systems

Stephan Ehrlich,Jonas Moellmann,et al.

2012413 citations

On the Importance of the Dispersion Energy for the Thermodynamic Stability of Molecules

Stefan Grimme,Robert Huenerbein,et al.

2011217 citations

Automated Transition State Search and Its Application to Diverse Types of Organic Reactions

Leif D. Jacobson,Arteum D. Bochevarov,et al.

2017172 citations

A DFT-D study of structural and energetic properties of TiO<sub>2</sub>modifications

Jonas Moellmann,Stephan Ehrlich,et al.

201272 citations

Towards full Quantum‐Mechanics‐based Protein–Ligand Binding Affinities

Stephan Ehrlich,Andreas H. Göller,et al.

201768 citations