Frank Eckert

7.5k total citations · 4 hit papers
48 papers, 6.3k citations indexed

About

Frank Eckert is a scholar working on Organic Chemistry, Atomic and Molecular Physics, and Optics and Biomedical Engineering. According to data from OpenAlex, Frank Eckert has authored 48 papers receiving a total of 6.3k indexed citations (citations by other indexed papers that have themselves been cited), including 25 papers in Organic Chemistry, 18 papers in Atomic and Molecular Physics, and Optics and 13 papers in Biomedical Engineering. Recurrent topics in Frank Eckert's work include Advanced Chemical Physics Studies (13 papers), Phase Equilibria and Thermodynamics (12 papers) and Chemical Thermodynamics and Molecular Structure (12 papers). Frank Eckert is often cited by papers focused on Advanced Chemical Physics Studies (13 papers), Phase Equilibria and Thermodynamics (12 papers) and Chemical Thermodynamics and Molecular Structure (12 papers). Frank Eckert collaborates with scholars based in Germany, United States and Poland. Frank Eckert's co-authors include Andreas Klamt, Michael Diedenhofen, Wolfgang Arlt, John C. W. Lohrenz, Ansgar Schäfer, Michael E. Beck, Hans‐Joachim Werner, Guntram Rauhut, Urszula Domańska and Aneta Pobudkowska and has published in prestigious journals such as Journal of the American Chemical Society, The Journal of Physical Chemistry B and Chemical Physics Letters.

In The Last Decade

Frank Eckert

48 papers receiving 6.2k citations

Hit Papers

align trajectories sort by overperformance

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.

Fast solvent screening via quantum chemistry: COSMO‐RS approach

2002 1.5k citations Frank Eckert, Andreas Klamt profile →
COSMO-RS: a novel and efficient method for the a priori prediction of thermophysical data of liquids

2000 1.0k citations Andreas Klamt, Frank Eckert Fluid Phase Equilibria profile →
COSMO Implementation in TURBOMOLE: Extension of an efficient quantum chemical code towards liquid systems

2000 627 citations Andreas Klamt, Frank Eckert et al. Physical Chemistry Chemical Physics profile →
COSMO-RS: An Alternative to Simulation for Calculating Thermodynamic Properties of Liquid Mixtures

2010 500 citations Andreas Klamt, Frank Eckert et al. profile →

Author Peers

Peers are selected by citation overlap in the author's most active subfields. citations · hero ref

Author						Papers	Cites
Frank Eckert	2.1k	1.7k	1.4k	1.3k	1.1k	48	6.3k
Nobuyuki Matubayasi	879 0.4×	749 0.4×	2.0k 1.4×	1.4k 1.0×	658 0.6×	263	6.1k
Cinzia Chiappe	3.8k 1.8×	5.1k 3.0×	1.5k 1.0×	1.0k 0.8×	595 0.6×	244	9.2k
Robert D. Chirico	2.7k 1.3×	697 0.4×	2.5k 1.7×	1.4k 1.0×	405 0.4×	149	4.5k
Kenneth N. Marsh	2.9k 1.3×	3.5k 2.0×	4.8k 3.4×	1.0k 0.8×	669 0.6×	187	9.6k
Eugénia A. Macedo	1.0k 0.5×	2.3k 1.3×	2.8k 2.0×	2.0k 1.5×	948 0.9×	233	7.5k
J.‐L. M. Abboud	3.8k 1.8×	666 0.4×	689 0.5×	1.9k 1.5×	1.8k 1.7×	89	7.3k
Volker Jonas	3.8k 1.8×	718 0.4×	513 0.4×	1.6k 1.2×	624 0.6×	40	7.1k
Barbara Kirchner	2.9k 1.4×	7.4k 4.3×	2.1k 1.5×	2.7k 2.0×	1.8k 1.7×	267	13.8k
Luı́s M. N. B. F. Santos	3.3k 1.6×	4.7k 2.7×	2.4k 1.7×	2.1k 1.6×	521 0.5×	221	8.7k
Aleksandr V. Marenich	9.4k 4.4×	1.3k 0.7×	1.4k 1.0×	4.0k 3.0×	1.6k 1.6×	45	19.0k

Countries citing papers authored by Frank Eckert

Since Specialization

Citations

This map shows the geographic impact of Frank Eckert'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 Frank Eckert with the expected number of citations based on a country's size and research output (numbers larger than one mean the country cites Frank Eckert more than expected).

Fields of papers citing papers by Frank Eckert

Since Specialization

Physical SciencesHealth SciencesLife SciencesSocial Sciences

This network shows the impact of papers produced by Frank Eckert. 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 Frank Eckert. The network helps show where Frank Eckert may publish in the future.

Co-authorship network of co-authors of Frank Eckert

This figure shows the co-authorship network connecting the top 25 collaborators of Frank Eckert. A scholar is included among the top collaborators of Frank Eckert 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 Frank Eckert. Frank Eckert 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

Diedenhofen, Michael, et al.. (2023). COSMO-RS blind prediction of distribution coefficients and aqueous pKa values from the SAMPL8 challenge. Journal of Computer-Aided Molecular Design. 37(8). 395–405. 2 indexed citations

Eckert, Frank, et al.. (2022). Quantifying the effect of solvent on the morphology of organic crystals using a statistical thermodynamics approach. Journal of Crystal Growth. 591. 126712–126712. 8 indexed citations

Hagiwara, Satoshi, Tae Hoon Choi, Frank Eckert, et al.. (2021). Quantifying Uncertainties in Solvation Procedures for Modeling Aqueous Phase Reaction Mechanisms. The Journal of Physical Chemistry A. 125(1). 154–164. 29 indexed citations

Andersson, Martin, Frank Eckert, Jens Reinisch, & Andreas Klamt. (2017). Prediction of aliphatic and aromatic oil-water interfacial tension at temperatures >100 °C using COSMO-RS. Fluid Phase Equilibria. 476. 25–29. 17 indexed citations

Klamt, Andreas, Frank Eckert, Jens Reinisch, & Karin Wichmann. (2016). Prediction of cyclohexane-water distribution coefficients with COSMO-RS on the SAMPL5 data set. Journal of Computer-Aided Molecular Design. 30(11). 959–967. 56 indexed citations

Klamt, Andreas, Jens Reinisch, Frank Eckert, Jérôme Graton, & Jean‐Yves Le Questel. (2013). Interpretation of experimental hydrogen-bond enthalpies and entropies from COSMO polarisation charge densities. Physical Chemistry Chemical Physics. 15(19). 7147–7147. 32 indexed citations

Klamt, Andreas, Jens Reinisch, Frank Eckert, Arnim Hellweg, & Michael Diedenhofen. (2011). Polarization charge densities provide a predictive quantification of hydrogen bond energies. Physical Chemistry Chemical Physics. 14(2). 955–963. 56 indexed citations

Klamt, Andreas, Frank Eckert, & Michael Diedenhofen. (2009). Prediction or partition coefficients and activity coefficients of two branched compounds using COSMOtherm. Fluid Phase Equilibria. 285(1-2). 15–18. 52 indexed citations

Klamt, Andreas, Frank Eckert, & Michael Diedenhofen. (2009). Prediction of the Free Energy of Hydration of a Challenging Set of Pesticide-Like Compounds. The Journal of Physical Chemistry B. 113(14). 4508–4510. 63 indexed citations

10.

Opałło, Marcin, et al.. (2008). Probing carboxylate Gibbs transfer energies via liquid|liquid transfer at triple phase boundary electrodes: ion-transfer voltammetry versus COSMO-RS predictions. Physical Chemistry Chemical Physics. 10(26). 3925–3925. 34 indexed citations

11.

Eckert, Frank, Ivo Leito, Ivari Kaljurand, et al.. (2008). Prediction of acidity in acetonitrile solution with COSMO‐RS. Journal of Computational Chemistry. 30(5). 799–810. 182 indexed citations

12.

Klamt, Andreas & Frank Eckert. (2008). Comment on “Refinement of COSMO−SAC and the Applications”. Industrial & Engineering Chemistry Research. 47(4). 1351–1352. 2 indexed citations

13.

Klamt, Andreas & Frank Eckert. (2006). Comment on “Application of the COSMO-SAC-BP Solvation Model to Predictions of Normal Boiling Temperatures for Environmentally Significant Substances”. Industrial & Engineering Chemistry Research. 45(10). 3766–3766. 3 indexed citations

14.

Eckert, Frank & Andreas Klamt. (2005). Accurate prediction of basicity in aqueous solution with COSMO‐RS. Journal of Computational Chemistry. 27(1). 11–19. 152 indexed citations

15.

Klamt, Andreas, et al.. (2001). COSMO-RS: A novel view to physiological solvation and partition questions. Journal of Computer-Aided Molecular Design. 15(4). 355–365. 110 indexed citations

16.

Klamt, Andreas, et al.. (2001). Prediction of aqueous solubility of drugs and pesticides with COSMO‐RS. Journal of Computational Chemistry. 23(2). 275–281. 220 indexed citations

17.

Eckert, Frank & Hans‐Joachim Werner. (1999). Local interpolation of ab initio potential energy surfaces for direct dynamics studies of chemical reactions. Chemical Physics Letters. 302(3-4). 208–214. 14 indexed citations

18.

Rauhut, Guntram & Frank Eckert. (1999). Quantum Chemical Studies on the Reactivity of Electron-Rich Heterocycles: Benzofuroxans. Science Progress. 82(3). 209–231. 8 indexed citations

19.

Eckert, Frank & Hans‐Joachim Werner. (1998). Reaction path following by quadratic steepest descent. Theoretical Chemistry Accounts. 100(1-4). 21–30. 38 indexed citations

20.

Eckert, Frank, Péter Pulay, & Hans‐Joachim Werner. (1997). Ab initio geometry optimization for large molecules. Journal of Computational Chemistry. 18(12). 1473–1483. 150 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.

Explore authors with similar magnitude of impact