ul. C. K. Norwida 4/6, Wrocław
bud. C-6, pok. 115 A
tel. 71 320 2119

Konsultacje

Zainteresowania naukowe

• Modelowanie molekularne Monte Carlo; adsorpcja w strukturach porowatych; deformacje strukturalne w układach porowatych; adsorpcja gazów w porach.

Najważniejsze publikacje z ostatnich lat

2024

• Bartosz Mazur, Lucyna Firlej, and Bogdan Kuchta, Efficient Modeling of Water Adsorption in MOFs Using Interpolated Transition Matrix Monte Carlo, ACS Applied Materials & Interfaces (2024) 16 (19), 25559-25567

2023

• Filip Formalik,* Michael Fischer, and Bogdan Kuchta, Correlating Phonons and Deformations: A Method for Structural Phase Transformation Analysis in Metal−Organic Frameworks, Cryst. Growth Des. (2023) 23, 8962−8971

2022

• Bartosz Mazur, Filip Formalik, Kornel Roztocki, Volodymyr Bon, Stefan Kaskel, Alexander V. Neimark,
  Lucyna Firlej, and Bogdan Kuchta, Quasicontinuous Cooperative Adsorption Mechanism in Crystalline Nanoporous Materials  J. Phys. Chem. Lett. (2022) 13, 6961−6965

2021

• Justyna Rogacka, Agnieszka Seremak, Azahara Luna-Triguero, Filip Formalik, Ismael Matito-Martos, Lucyna Firleja, Sofia Calero, Bogdan Kuchta, High-throughput screening of metal – Organic frameworks for CO₂ and CH₄ separation in the presence of water, Chemical Engineering Journal 403 (2021) 126392

2020

• Nicolas Chanut, Aziz Ghoufi, Marie-Vanessa Coulet, Sandrine Bourrelly, Bogdan Kuchta,
  Guillaume Maurin, Philip L. Llewellyn, Tailoring the separation properties of flexible metal-organic frameworks using mechanical pressure, NATURE COMMUNICATIONS (2020) 11:1216

2019

• Alexander St. John, Michael W. Roth, Lucyna Firlej, Bogdan Kuchta, Fabrice Charra and Carlos Wexler, Computer modeling of 2D supramolecular nanoporous monolayers self-assembled on graphite, Nanoscale, 2019, 11, 21284

2017

• Kuchta B., Dundar E., Formalik F., Firlej L., Llewellyn P.L., Adsorption induced structural phase transformation in nanopores, Angewandte Chimie In. Ed. (2017), 56, 16243-16246.

2013

• Firlej L., Pfeifer P., Kuchta B.,Understanding Universal Adsorption Limits for Hydrogen Storage in Nano Porous Systems. Advanced Materials (2013) 25, 5971-5974.

2012

• Kuchta B., Firlej L., Mohammadhosseini A., Boulet P., Beckner M., Romanos J., Pfeifer P., High-Surface-Area Carbons with Exceptional Hydrogen Storage Capacities: Open Carbon Frameworks. J. Am. Chem. Soc. (2012) 134, 15130-15137.

2010

• Beurroies I., Boulhout M., Llewellyn P.L., Kuchta B., Férey G., Serre Ch., Denoyel R., Using pressure to provoke the structural transition of MOF materials. Ang. Chimie Int. Ed. 49, 7526 -7529 (2010).
• Kuchta B., Firlej L., Pfeifer P., Wexler C., Numerical estimation of physical limits of hydrogen storage by physisorption in microporous nanospaces. Carbon 48, 223-231 (2010).

Publikacje w bazie DONA

Wybrane publikacje
1	Artykuł 2026 Małgorzata Stankiewicz Anthony Dorhauer, Kornel Roztocki, Volodymyr Bon, Bartosz Mazur Carlos Wexler, Stefan Kaskel, Lucyna Firlej Bogdan Kuchta Adsorption mechanism in crystalline micropores: multimodal fluctuations, metastability and phase transformations in nanoconfinement. ACS Nano. 2026, vol. 20, nr 5, s. 4204-4216. ISSN: 1936-0851; 1936-086X Zasoby:DOISFX
2	Artykuł 2025 Anthony Dorhauer, Małgorzata Stankiewicz Bartosz Mazur Bogdan Kuchta Carlos Wexler, Free energy landscapes and metastability in methane adsorption within a representative metal–organic framework. ACS Omega. 2025, vol. 10, nr 51, s. 63044-63050. ISSN: 2470-1343; 2470-1343 Zasoby:DOISFX
3	Artykuł 2025 Szymon Sobczak, Bartosz Mazur Maura Malinska, Filip Formalik Volodymyr Bon, Azat Khadiev, Stefan Kaskel, Bogdan Kuchta Agnieszka Janiak, Kornel Roztocki, How a single atom influences the spatiotemporal response of flexible MOFs: insights from theory and experiment. Journal of the American Chemical Society. 2025, vol. 47, nr 25, s. 21575-21585. ISSN: 0002-7863; 1520-5126 Zasoby:DOIURLSFX
4	Artykuł 2025 Filip Formalik Bartosz Mazur Faramarz Joodaki, Bogdan Kuchta Randall Q Snurr, Small rotations, big effects: lessons from water adsorption in NU-1000. Journal of Physical Chemistry C. 2025, vol. 129, nr 7, s. 3752-3761. ISSN: 1932-7447; 1932-7455 Zasoby:DOISFX
5	Artykuł 2024 Elżbieta Dziadyk-Stopyra, Justyna M Rogacka Agata Z Podsiadły-Paszkowska Przemysław Kawecki, Bogdan Kuchta Bartłomiej Szyja Toward rational design of Zr-MOF for CO2/CH4 mixture separation. Separation Science and Technology. 2024, vol. 59, nr 6-9, s. 940-953. ISSN: 0149-6395; 1520-5754 Zasoby:DOIURLSFX
6	Artykuł 2024 Bartosz Mazur Lucyna Firlej Bogdan Kuchta Efficient modeling of water adsorption in MOFs using interpolated transition matrix Monte Carlo. ACS Applied Materials and Interfaces. 2024, vol. 16, nr 19, s. 25559-25567. ISSN: 1944-8244; 1944-8252 Zasoby:DOISFX
7	Artykuł 2024 Justyna M Rogacka Patryk H Pakuła Bartosz Mazur Lucyna Firlej Bogdan Kuchta Advancing biogas purification: a systematic numerical study of MOF performance under humid conditions. Chemical Engineering Journal. 2024, vol. 486, art. 150097, s. 1-16. ISSN: 1385-8947; 1873-3212 Zasoby:DOISFX
8	Artykuł 2023 Filip Formalik Michael Fischer, Bogdan Kuchta Correlating phonons and deformations: a method for structural phase transformation analysis in metal-organic frameworks. Crystal Growth & Design. 2023, vol. 23, nr 12, s. 8962–8971. ISSN: 1528-7483; 1528-7505 Zasoby:DOIURLSFX
9	Artykuł 2022 Bartosz Mazur Filip Formalik Kornel Roztocki, Volodymyr Bon, Stefan Kaskel, Alexander V Neimark, Lucyna Firlej Bogdan Kuchta Quasicontinuous cooperative adsorption mechanism in crystalline nanoporous materials. Journal of Physical Chemistry Letters. 2022, vol. 13, nr 30, s. 6961-6965. ISSN: 1948-7185 Zasoby:DOISFX
10	Artykuł 2022 Kornel Roztocki, Filip Formalik Volodymyr Bon, Anna Krawczuk, Piotr Goszczycki, Bogdan Kuchta Stefan Kaskel, Dariusz Matoga, Tuning adsorption-induced responsiveness of a flexible metal–organic framework JUK-8 by linker halogenation. Chemistry of Materials. 2022, vol. 34, nr 7, s. 3430-3439. ISSN: 0897-4756; 1520-5002 Zasoby:DOIURLSFX
11	Artykuł 2021 Lucyna Firlej Bogdan Kuchta Katarzyna Walczak, Catherine Journet, Hydrogen storage in pure and boron-substituted nanoporous carbons - numerical and experimental perspective. Nanomaterials. 2021, vol. 11, nr 9, art. 2173, s. 1-15. ISSN: 2079-4991 Zasoby:DOISFX

Wszystkie publikacje pracownika