Małgorzata Biczysko

7.4k total citations · 2 hit papers
119 papers, 5.9k citations indexed

About

Małgorzata Biczysko is a scholar working on Atomic and Molecular Physics, and Optics, Spectroscopy and Physical and Theoretical Chemistry. According to data from OpenAlex, Małgorzata Biczysko has authored 119 papers receiving a total of 5.9k indexed citations (citations by other indexed papers that have themselves been cited), including 89 papers in Atomic and Molecular Physics, and Optics, 61 papers in Spectroscopy and 36 papers in Physical and Theoretical Chemistry. Recurrent topics in Małgorzata Biczysko's work include Advanced Chemical Physics Studies (75 papers), Spectroscopy and Quantum Chemical Studies (42 papers) and Molecular Spectroscopy and Structure (30 papers). Małgorzata Biczysko is often cited by papers focused on Advanced Chemical Physics Studies (75 papers), Spectroscopy and Quantum Chemical Studies (42 papers) and Molecular Spectroscopy and Structure (30 papers). Małgorzata Biczysko collaborates with scholars based in Italy, China and United States. Małgorzata Biczysko's co-authors include Vincenzo Barone, Julien Bloino, Cristina Puzzarini, Fabrizio Santoro, Alberto Baiardi, Paweł T. Panek, Teresa Fornaro, Emanuele Penocchio, Ivan Carnimeo and Zdzisław Latajka and has published in prestigious journals such as Nature Communications, The Journal of Chemical Physics and Accounts of Chemical Research.

In The Last Decade

Małgorzata Biczysko

117 papers receiving 5.9k 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.

Fully Integrated Approach to Compute Vibrationally Resolved Optical Spectra: From Small Molecules to Macrosystems

2009 409 citations Vincenzo Barone, Julien Bloino et al. profile →
Fully anharmonic IR and Raman spectra of medium-size molecular systems: accuracy and interpretation

2013 376 citations Vincenzo Barone, Małgorzata Biczysko et al. profile →

Peers

Małgorzata Biczysko

AMPO

SPECT

PTC

T. Daniel Crawford United States

Julien Bloino Italy

Joanna Sadlej Poland

E. Arunan India

Stephan P. A. Sauer Denmark

Mihály Kállay Hungary

Asuka Fujii Japan

Karl Kleinermanns Germany

Jingjing Zheng United States

Ingo Fischer Germany

T. Daniel Crawford United States

Małgorzata Biczysko

4.2k ×1.1

AMPO

2.7k ×1.0

SPECT

972 ×0.7

PTC

1.2k ×1.1

1.2k ×1.2

Citations per year, relative to Małgorzata Biczysko Małgorzata Biczysko (= 1×) peers T. Daniel Crawford

Countries citing papers authored by Małgorzata Biczysko

Since Specialization

Citations

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

Fields of papers citing papers by Małgorzata Biczysko

Since Specialization

Physical SciencesHealth SciencesLife SciencesSocial Sciences

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

Co-authorship network of co-authors of Małgorzata Biczysko

This figure shows the co-authorship network connecting the top 25 collaborators of Małgorzata Biczysko. A scholar is included among the top collaborators of Małgorzata Biczysko 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 Małgorzata Biczysko. Małgorzata Biczysko is excluded from the visualization to improve readability, since they are connected to all nodes in the network.

All Works

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20 of 20 papers shown

Zubatyuk, R.I., Małgorzata Biczysko, Nigel W. Moriarty, et al.. (2025). AQuaRef: machine learning accelerated quantum refinement of protein structures. Nature Communications. 16(1). 9224–9224. 2 indexed citations

Yang, Qin, et al.. (2025). Reliable Modeling of Anharmonic Spectra Line-Shapes from VPT2 and Hybrid QM Models: IR Spectrum of Uracil as a Test Case. The Journal of Physical Chemistry A. 129(26). 5860–5880. 1 indexed citations

Yang, Qin, et al.. (2024). Harmonic and anharmonic vibrational computations for biomolecular building blocks: Benchmarking DFT and basis sets by theoretical and experimental IR spectrum of glycine conformers. Journal of Computational Chemistry. 45(21). 1846–1869. 11 indexed citations

Li, Xinxing, Xuyi Li, Małgorzata Biczysko, et al.. (2023). Isomerization-induced fluorescence enhancement of two new viologen derivatives: mechanism insight and DFT calculations. Chemical Science. 14(25). 7016–7025. 7 indexed citations

Wang, Yaru, Holger Kruse, Nigel W. Moriarty, et al.. (2023). Optimal clustering for quantum refinement of biomolecular structures: Q|R#4. Theoretical Chemistry Accounts. 142(10). 2 indexed citations

Barone, Vincenzo, Silvia Alessandrini, Małgorzata Biczysko, et al.. (2021). Computational molecular spectroscopy. Nature Reviews Methods Primers. 1(1). 139 indexed citations

Kruse, Holger, Oleg V. Sobolev, Nigel W. Moriarty, et al.. (2020). Real-space quantum-based refinement for cryo-EM: Q | R #3. Acta Crystallographica Section D Structural Biology. 76(12). 1184–1191. 8 indexed citations

Zheng, Min, Małgorzata Biczysko, Nigel W. Moriarty, et al.. (2019). Including crystallographic symmetry in quantum-based refinement: Q | R #2. Acta Crystallographica Section D Structural Biology. 76(1). 41–50. 12 indexed citations

Rätsep, Margus, et al.. (2019). Absorption-emission symmetry breaking and the different origins of vibrational structures of the 1Qy and 1Qx electronic transitions of pheophytin a. The Journal of Chemical Physics. 151(16). 165102–165102. 11 indexed citations

10.

Palmer, Michael H., Marcello Coreno, Monica de Simone, et al.. (2017). A combined theoretical and experimental study of the ionic states of iodopentafluorobenzene. The Journal of Chemical Physics. 146(8). 84302–84302. 3 indexed citations

11.

Palmer, Michael H., Søren Vrønning Hoffmann, Nykola C. Jones, et al.. (2017). A combined theoretical and experimental study of the valence and Rydberg states of iodopentafluorobenzene. The Journal of Chemical Physics. 146(17). 174301–174301. 3 indexed citations

12.

Palmer, Michael H., Małgorzata Biczysko, Alberto Baiardi, et al.. (2017). The ionic states of difluoromethane: A reappraisal of the low energy photoelectron spectrum including ab initio configuration interaction computations. The Journal of Chemical Physics. 147(7). 74305–74305. 2 indexed citations

13.

Palmer, Michael H., Trevor Ridley, Søren Vrønning Hoffmann, et al.. (2016). Combined theoretical and experimental study of the valence, Rydberg and ionic states of fluorobenzene. The Journal of Chemical Physics. 144(20). 17 indexed citations

14.

Palmer, Michael H., Trevor Ridley, Søren Vrønning Hoffmann, et al.. (2016). Combined theoretical and experimental study of the valence, Rydberg, and ionic states of chlorobenzene. The Journal of Chemical Physics. 144(12). 124302–124302. 15 indexed citations

15.

Ridley, Trevor, et al.. (2016). クロロベンゼンの原子価,Rydberg,およびイオン状態に関する理論と実験を結びつけた研究. The Journal of Chemical Physics. 144(12). 21.

16.

Palmer, Michael H., Trevor Ridley, Søren Vrønning Hoffmann, et al.. (2015). Interpretation of the vacuum ultraviolet photoabsorption spectrum of iodobenzene by ab initio computations. The Journal of Chemical Physics. 142(13). 134302–134302. 58 indexed citations

17.

Palmer, Michael H., Trevor Ridley, Søren Vrønning Hoffmann, et al.. (2015). The ionic states of iodobenzene studied by photoionization and ab initio configuration interaction and DFT computations. The Journal of Chemical Physics. 142(13). 134301–134301. 21 indexed citations

18.

Palmer, Michael H., Trevor Ridley, Søren Vrønning Hoffmann, et al.. (2015). Interpretation of the photoelectron, ultraviolet, and vacuum ultraviolet photoabsorption spectra of bromobenzene by ab initio configuration interaction and DFT computations. The Journal of Chemical Physics. 143(16). 164303–164303. 20 indexed citations

19.

Pedone, Alfonso, Małgorzata Biczysko, & Vincenzo Barone. (2010). Environmental Effects in Computational Spectroscopy: Accuracy and Interpretation. ChemPhysChem. 11(9). 1812–1832. 63 indexed citations

20.

Biczysko, Małgorzata, et al.. (2000). Solvent effect on hydrogen bonded ammonia–hydrogen halide complexes: continuum medium versus cluster models. Computers & Chemistry. 24(3-4). 303–309. 21 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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