Michael Gaus

3.7k total citations · 2 hit papers
23 papers, 2.9k citations indexed

About

Michael Gaus is a scholar working on Atomic and Molecular Physics, and Optics, Physical and Theoretical Chemistry and Spectroscopy. According to data from OpenAlex, Michael Gaus has authored 23 papers receiving a total of 2.9k indexed citations (citations by other indexed papers that have themselves been cited), including 15 papers in Atomic and Molecular Physics, and Optics, 9 papers in Physical and Theoretical Chemistry and 5 papers in Spectroscopy. Recurrent topics in Michael Gaus's work include Advanced Chemical Physics Studies (11 papers), Spectroscopy and Quantum Chemical Studies (7 papers) and Crystallography and molecular interactions (7 papers). Michael Gaus is often cited by papers focused on Advanced Chemical Physics Studies (11 papers), Spectroscopy and Quantum Chemical Studies (7 papers) and Crystallography and molecular interactions (7 papers). Michael Gaus collaborates with scholars based in Germany, United States and Switzerland. Michael Gaus's co-authors include Marcus Elstner, Qiang Cui, Xiya Lu, Tomáš Kubař, Jan Řezáč, Maximilian Kubillus, Puja Goyal, Steve Kaminski, Henryk A. Witek and Chien‐Pin Chou and has published in prestigious journals such as Journal of the American Chemical Society, The Journal of Physical Chemistry B and Journal of The Electrochemical Society.

In The Last Decade

Michael Gaus

22 papers receiving 2.9k citations

Hit Papers

align trajectories

What are hit papers?

Hit papers significantly outperform the citation benchmark for their cohort. A paper qualifies if it has ≥500 total citations, achieves ≥1.5× the top-1% citation threshold for papers in the same subfield and year (this is the minimum needed to enter the top 1%, not the average within it), or reaches the top citation threshold in at least one of its specific research topics.

DFTB3: Extension of the Self-Consistent-Charge Density-Functional Tight-Binding Method (SCC-DFTB)

2011 878 citations Michael Gaus, Qiang Cui et al. Journal of Chemical Theory and Computation profile →
Parametrization and Benchmark of DFTB3 for Organic Molecules

2012 790 citations Michael Gaus, Marcus Elstner et al. Journal of Chemical Theory and Computation profile →

Peers — A (Enhanced Table)

Peers by citation overlap · career bar shows stage (early→late) cites · hero ref

Name	h						Papers	Cites
Michael Gaus Germany	17	1.1k	1.1k	836	495	413	23	2.9k
Daniel S. Lambrecht United States	25	1.4k 1.2×	753 0.7×	628 0.8×	410 0.8×	488 1.2×	41	2.7k
Jingzhi Pu United States	27	1.1k 1.0×	646 0.6×	1.0k 1.2×	333 0.7×	358 0.9×	55	2.5k
Toshio Asada Japan	26	1.5k 1.3×	991 0.9×	643 0.8×	349 0.7×	433 1.0×	104	3.2k
Takashi Imai Japan	49	1.6k 1.5×	1.1k 1.0×	1.1k 1.3×	321 0.6×	330 0.8×	166	6.5k
Chris‐Kriton Skylaris United Kingdom	36	1.9k 1.7×	1.6k 1.5×	769 0.9×	468 0.9×	357 0.9×	145	4.3k
Haibo Yu Australia	34	1.6k 1.4×	1.2k 1.1×	2.0k 2.4×	418 0.8×	610 1.5×	124	4.8k
Harald Lanig Germany	22	942 0.9×	690 0.6×	1.4k 1.7×	496 1.0×	572 1.4×	60	3.6k
Christoph Bauer Germany	17	814 0.7×	824 0.8×	314 0.4×	348 0.7×	498 1.2×	38	2.4k
Marco Pagliai Italy	28	864 0.8×	702 0.7×	531 0.6×	324 0.7×	344 0.8×	121	2.5k
Tomáš Kubař Germany	26	978 0.9×	535 0.5×	1.2k 1.4×	569 1.1×	229 0.6×	63	2.6k

Countries citing papers authored by Michael Gaus

Since Specialization

Citations

This map shows the geographic impact of Michael Gaus's research. It shows the number of citations coming from papers published by authors working in each country. You can also color the map by specialization and compare the number of citations received by Michael Gaus with the expected number of citations based on a country's size and research output (numbers larger than one mean the country cites Michael Gaus more than expected).

Fields of papers citing papers by Michael Gaus

Since Specialization

Physical SciencesHealth SciencesLife SciencesSocial Sciences

This network shows the impact of papers produced by Michael Gaus. Nodes represent research fields, and links connect fields that are likely to share authors. Colored nodes show fields that tend to cite the papers produced by Michael Gaus. The network helps show where Michael Gaus may publish in the future.

Co-authorship network of co-authors of Michael Gaus

This figure shows the co-authorship network connecting the top 25 collaborators of Michael Gaus. A scholar is included among the top collaborators of Michael Gaus based on the total number of citations received by their joint publications. Widths of edges represent the number of papers authors have co-authored together. Node borders signify the number of papers an author published with Michael Gaus. Michael Gaus is excluded from the visualization to improve readability, since they are connected to all nodes in the network.

All Works

Sort: Min cites: Since: Top N: Style:

20 of 20 papers shown

Gluch, Jürgen, et al.. (2024). Unveiling the Interplay of Structural and Electrochemical Degradation of LiNi_0.85Mn_0.05Co_0.05O₂ Cathode Material for Li-Ion Batteries. Journal of The Electrochemical Society. 171(8). 80521–80521. 3 indexed citations

Gluch, Jürgen, et al.. (2023). An Efficient Approach for Quantifying the Mechanical Degradation of Ni‐Rich NMC‐based Cathodes for Lithium‐Ion Batteries using Nano‐XCT Analysis. ChemElectroChem. 10(20). 2 indexed citations

Braun, Thomas, et al.. (2016). Potential analysis of the use of electric storage heaters for demand side management applications. 284–291. 1 indexed citations

Gaus, Michael. (2016). Der neue § 108 GWB. 16(4). 1 indexed citations

Gaus, Michael, et al.. (2015). DFTB3 Parametrization for Copper: The Importance of Orbital Angular Momentum Dependence of Hubbard Parameters. Journal of Chemical Theory and Computation. 11(9). 4205–4219. 33 indexed citations

Goyal, Puja, et al.. (2015). Copper Oxidation/Reduction in Water and Protein: Studies with DFTB3/MM and VALBOND Molecular Dynamics Simulations. The Journal of Physical Chemistry B. 120(8). 1894–1910. 25 indexed citations

Gaus, Michael, Xiya Lu, Marcus Elstner, & Qiang Cui. (2014). Parameterization of DFTB3/3OB for Sulfur and Phosphorus for Chemical and Biological Applications. Journal of Chemical Theory and Computation. 10(4). 1518–1537. 276 indexed citations

Kubillus, Maximilian, Tomáš Kubař, Michael Gaus, Jan Řezáč, & Marcus Elstner. (2014). Parameterization of the DFTB3 Method for Br, Ca, Cl, F, I, K, and Na in Organic and Biological Systems. Journal of Chemical Theory and Computation. 11(1). 332–342. 239 indexed citations

Lu, Xiya, Michael Gaus, Marcus Elstner, & Qiang Cui. (2014). Parametrization of DFTB3/3OB for Magnesium and Zinc for Chemical and Biological Applications. The Journal of Physical Chemistry B. 119(3). 1062–1082. 142 indexed citations

10.

Welke, Kai, et al.. (2013). QM/MM simulations of vibrational spectra of bacteriorhodopsin and channelrhodopsin-2. Physical Chemistry Chemical Physics. 15(18). 6651–6651. 23 indexed citations

11.

Goldman, Nir, Sriram Goverapet Srinivasan, Sébastien Hamel, et al.. (2013). Determination of a Density Functional Tight Binding Model with an Extended Basis Set and Three-Body Repulsion for Carbon Under Extreme Pressures and Temperatures. The Journal of Physical Chemistry C. 117(15). 7885–7894. 31 indexed citations

12.

Kubař, Tomáš, Zoltán Bodrog, Michael Gaus, et al.. (2013). Parametrization of the SCC-DFTB Method for Halogens. Journal of Chemical Theory and Computation. 9(7). 2939–2949. 53 indexed citations

13.

Gaus, Michael, Qiang Cui, & Marcus Elstner. (2013). Density functional tight binding: application to organic and biological molecules. Wiley Interdisciplinary Reviews Computational Molecular Science. 4(1). 49–61. 173 indexed citations

14.

Gaus, Michael, et al.. (2012). Parametrization and Benchmark of DFTB3 for Organic Molecules. Journal of Chemical Theory and Computation. 9(1). 338–354. 790 indexed citations breakdown →

15.

Kaminski, Steve, Michael Gaus, & Marcus Elstner. (2012). Improved Electronic Properties from Third-Order SCC-DFTB with Cost Efficient Post-SCF Extensions. The Journal of Physical Chemistry A. 116(48). 11927–11937. 16 indexed citations

16.

Goyal, Puja, Nilanjan Ghosh, Prasad Phatak, et al.. (2011). Proton Storage Site in Bacteriorhodopsin: New Insights from Quantum Mechanics/Molecular Mechanics Simulations of Microscopic pK_a and Infrared Spectra. Journal of the American Chemical Society. 133(38). 14981–14997. 56 indexed citations

17.

Gaus, Michael. (2011). Extension and Parametrization of an Approximate Density Functional Method for Organic and Biomolecules. Repository KITopen (Karlsruhe Institute of Technology). 2 indexed citations

18.

Gaus, Michael, Qiang Cui, & Marcus Elstner. (2011). DFTB3: Extension of the Self-Consistent-Charge Density-Functional Tight-Binding Method (SCC-DFTB). Journal of Chemical Theory and Computation. 7(4). 931–948. 878 indexed citations breakdown →

19.

Kaminski, Steve, Michael Gaus, Prasad Phatak, et al.. (2010). Vibrational Raman Spectra from the Self-Consistent Charge Density Functional Tight Binding Method via Classical Time-Correlation Functions. Journal of Chemical Theory and Computation. 6(4). 1240–1255. 18 indexed citations

20.

Gaus, Michael, Chien‐Pin Chou, Henryk A. Witek, & Marcus Elstner. (2009). Automatized Parametrization of SCC-DFTB Repulsive Potentials: Application to Hydrocarbons. The Journal of Physical Chemistry A. 113(43). 11866–11881. 64 indexed citations

Rankless uses publication and citation data sourced from OpenAlex, an open and comprehensive bibliographic database. While OpenAlex provides broad and valuable coverage of the global research landscape, it—like all bibliographic datasets—has inherent limitations. These include incomplete records, variations in author disambiguation, differences in journal indexing, and delays in data updates. As a result, some metrics and network relationships displayed in Rankless may not fully capture the entirety of a scholar's output or impact.

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