Fabian Bohle

5PUBLICATIONS
16CO-AUTHORS
Computational chemistryTheoretical quantum chemistryOrganometallic chemistry
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Publications (5)

|Mar 21, 2024
CREST-A program for the exploration of low-energy molecular chemical space.

Philipp Pracht, Stefan Grimme, Christoph Bannwarth

|Jan 31, 2022
Hydrocarbon Macrocycle Conformer Ensembles and 13 C-NMR Spectra.

Fabian Bohle, Stefan Grimme

|Oct 06, 2021
Automated Quantum Chemistry-Based Calculation of Optical Rotation for Large Flexible Molecules.

Fabian Bohle, Jakob Seibert, Stefan Grimme

|Mar 10, 2021
Efficient Quantum Chemical Calculation of Structure Ensembles and Free Energies for Nonrigid Molecules.

Stefan Grimme, Fabian Bohle, Andreas Hansen

|Nov 27, 2020
Oxidation Under Reductive Conditions: From Benzylic Ethers to Acetals with Perfect Atom-Economy by Titanocene(III) Catalysis.

Pierre Funk, Ruben B Richrath, Fabian Bohle

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