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Brandenburg, Jan Gerit
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ResearcherID: K-2148-2014
Other Names: Brandenburg, J. G.
URL: http://www.researcherid.com/rid/K-2148-2014
Subject: Chemistry; Materials Science; Physics
Keywords: quamtum chemistry; organic solids; density functional theory; electronic strcuture of materials; crystal structure modelling
My Institutions (more details)
Primary Institution:
Sub-org/Dept: London Centre for Nanotechnology
Role:
Past Institutions: Heidelberg University; University of Bonn
My URLs: http://www.gerit-brandenburg.de
 
 

This list contains papers that I have authored.

publication(s)  
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1.  Title: Assessment of Different Quantum Mechanical Methods for the Prediction of Structure and Cohesive Energy of Molecular Crystals
 Author(s): Cutini, M.; Civalleri, B.; Corno, M.; et al.
 Source: J. Chem. Theory Comput. Volume: 12 Pages: 3340-3352 Published: 2016//
 Times Cited: 5
 DOI: 10.1021/acs.jctc.6b00304
added
03-Nov-16
2.  Title: Benchmark tests of a strongly constrained semilocal functional with a long-range dispersion correction
 Author(s): Brandenburg, J. G.; Bates, J. E.; Sun, J.; et al.
 Source: Phys. Rev. B Volume: 94 Pages: 115144 Published: 2016//
 Times Cited: 9
 DOI: 10.1103/PhysRevB.94.115144
added
03-Nov-16
3.  Title: Dispersion-Corrected Mean-Field Electronic Structure Methods
 Author(s): Grimme, S.; Hansen, A.; Brandenburg, J. G.; et al.
 Source: Chem. Rev. Volume: 116 Pages: 5105-5154 Published: 2016//
 Times Cited: 105
 DOI: 10.1021/acs.chemrev.5b00533
added
03-Nov-16
4.  Title: Organic crystal polymorphism: A benchmark for dispersion corrected mean field electronic structure methods
 Author(s): Brandenburg, J. G.; Grimme, S.
 Source: Acta Cryst. B Volume: 72 Pages: 502-513 Published: 2016//
 Times Cited: 6
 DOI: 10.1107/S2052520616007885
added
03-Nov-16
5.  Title: Report on the Sixth Blind Test of Organic Crystal-Structure Prediction Methods
 Author(s): Reilly, Anthony M.; Cooper, Richard I.; Adjiman, Claire S.; et al.
 Source: Acta Cryst. B Volume: 72 Pages: 439-459 Published: 2016//
 Times Cited: 44
 DOI: 10.1107/S2052520616007447
added
03-Nov-16
6.  Title: Screened exchange hybrid density functional for accurate and efficient structures and interaction energies
 Author(s): Brandenburg, J. G.; Caldeweyher, E.; Grimme, S.
 Source: Phys. Chem. Chem. Phys. Volume: 18 Pages: 15519-15523 Published: 2016//
 Times Cited: 8
 DOI: 10.1039/c6cp01697a
added
03-Nov-16
7.  Title: Small atomic orbital basis set first-principles quantum chemical methods for large molecular and periodic systems
 Author(s): Sure, R.; Brandenburg, J. G.; Grimme, S.
 Source: ChemistryOpen Volume: 5 Pages: 94-109 Published: 2016//
 Times Cited: 13
 DOI: 10.1002/open.201500192
added
03-Nov-16
8.  Title: A Case Study of Mechanical Strain in Supramolecular Complexes to Manipulate the Spin State of Iron(II) Centres
 Author(s): Struch, Niklas; Brandenburg, Jan Gerit; Schnakenburg, Gregor; et al.
 Source: Eur. J. Inorg. Chem. Volume: 33 Pages: 5503-5510 Published: 2015//
 Times Cited: 3
 DOI: 10.1002/ejic.201501057
added
03-Nov-16
9.  Title: Benchmarking DFT and Semiempirical Methods on Structures and Lattice Energies for Ten Ice Polymorphs
 Author(s): Brandenburg, J. G.; Maas, T.; Grimme, S.
 Source: J. Chem. Phys. Volume: 142 Pages: 124104 Published: 2015//
 Times Cited: 26
 DOI: 10.1063/1.4916070
added
03-Nov-16
10.  Title: Consistent structures and interactions by density functional theory with small atomic orbital basis sets
 Author(s): Grimme, Stefan; Brandenburg, Jan Gerit; Bannwarth, Christoph; et al.
 Source: J. Chem. Phys. Volume: 143 Pages: 054107 Published: 2015//
 Times Cited: 59
 DOI: 10.1063/1.4927476
added
03-Nov-16
publication(s)  
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