@article{MTMT:34019626,
	title = {Total Synthesis and Structural Plasticity of Kratom Pseudoindoxyl Metabolites},
	url = {https://m2.mtmt.hu/api/publication/34019626},
	author = {Angyal, Péter and Hegedüs, Kristóf and Mészáros, Bence Balázs and Daru, János and Dudás, Ádám and Galambos, Anna Rita and Gomaa, Nariman Essmat Mohamed Aldeltawab and Al-Khrasani, Mahmoud and Varga, Szilárd and Soós, Tibor},
	doi = {10.1002/anie.202303700},
	journal-iso = {ANGEW CHEM INT EDIT},
	journal = {ANGEWANDTE CHEMIE-INTERNATIONAL EDITION},
	volume = {62},
	unique-id = {34019626},
	issn = {1433-7851},
	year = {2023},
	eissn = {1521-3773},
	orcid-numbers = {Daru, János/0000-0002-5630-6311; Dudás, Ádám/0000-0002-6841-8185; Gomaa, Nariman Essmat Mohamed Aldeltawab/0000-0003-3440-6263; Al-Khrasani, Mahmoud/0000-0001-8488-3266; Varga, Szilárd/0000-0001-9611-5168}
}

@article{MTMT:33329463,
	title = {Coupled Cluster Molecular Dynamics of Condensed Phase Systems Enabled by Machine Learning Potentials: Liquid Water Benchmark},
	url = {https://m2.mtmt.hu/api/publication/33329463},
	author = {Daru, János and Forbert, Harald and Behler, Jörg and Marx, Dominik},
	doi = {10.1103/PhysRevLett.129.226001},
	journal-iso = {PHYS REV LETT},
	journal = {PHYSICAL REVIEW LETTERS},
	volume = {129},
	unique-id = {33329463},
	issn = {0031-9007},
	year = {2022},
	eissn = {1079-7114},
	orcid-numbers = {Daru, János/0000-0002-5630-6311; Forbert, Harald/0000-0002-9992-2376; Behler, Jörg/0000-0002-1220-1542}
}

@article{MTMT:32587729,
	title = {Competition between Coulomb and van der Waals Interactions in Xe − Cs + Aggregates on Cu(111) Surfaces},
	url = {https://m2.mtmt.hu/api/publication/32587729},
	author = {Thomas, J. and Bertram, C. and Daru, János and Patwari, J. and Langguth, I. and Zhou, P. and Marx, D. and Morgenstern, K. and Bovensiepen, U.},
	doi = {10.1103/PhysRevLett.127.266802},
	journal-iso = {PHYS REV LETT},
	journal = {PHYSICAL REVIEW LETTERS},
	volume = {127},
	unique-id = {32587729},
	issn = {0031-9007},
	year = {2021},
	eissn = {1079-7114},
	orcid-numbers = {Thomas, J./0000-0001-7621-4230; Daru, János/0000-0002-5630-6311; Bovensiepen, U./0000-0002-1506-4491}
}

@article{MTMT:32522266,
	title = {Revisiting the amine-catalysed cross-coupling},
	url = {https://m2.mtmt.hu/api/publication/32522266},
	author = {Novák, Zoltán and Adamik, Réka Anna and Csenki, János Tivadar and Béke, Ferenc and Gavaldik, Regina and Varga, Bálint and Nagy, Bálint and May, Zoltán and Daru, János and Gonda, Zsombor and Tolnai, Gergely László},
	doi = {10.1038/s41929-021-00709-8},
	journal-iso = {NAT CATAL},
	journal = {NATURE CATALYSIS},
	volume = {4},
	unique-id = {32522266},
	issn = {2520-1158},
	year = {2021},
	eissn = {2520-1158},
	pages = {991-993},
	orcid-numbers = {Novák, Zoltán/0000-0001-5525-3070; Daru, János/0000-0002-5630-6311; Tolnai, Gergely László/0000-0002-5253-5117}
}

@article{MTMT:31648579,
	title = {Terahertz Spectra of Microsolvated Ions: Do They Reveal Bulk Solvation Properties?},
	url = {https://m2.mtmt.hu/api/publication/31648579},
	author = {Gupta, Prashant Kumar and Schienbein, Philipp and Daru, János and Marx, Dominik},
	doi = {10.1021/acs.jpclett.8b03188},
	journal-iso = {J PHYS CHEM LETT},
	journal = {JOURNAL OF PHYSICAL CHEMISTRY LETTERS},
	volume = {10},
	unique-id = {31648579},
	issn = {1948-7185},
	year = {2019},
	pages = {393-398},
	orcid-numbers = {Daru, János/0000-0002-5630-6311}
}

@article{MTMT:31648567,
	title = {Restricting Solvation to Two Dimensions: Soft Landing of Microsolvated Ions on Inert Surfaces},
	url = {https://m2.mtmt.hu/api/publication/31648567},
	author = {Daru, János and Gupta, Prashant Kumar and Marx, Dominik},
	doi = {10.1021/acs.jpclett.8b03801},
	journal-iso = {J PHYS CHEM LETT},
	journal = {JOURNAL OF PHYSICAL CHEMISTRY LETTERS},
	volume = {10},
	unique-id = {31648567},
	issn = {1948-7185},
	year = {2019},
	pages = {831-835},
	orcid-numbers = {Daru, János/0000-0002-5630-6311}
}

@article{MTMT:30777661,
	title = {Effects of H-bond asymmetry on the electronic properties of liquid water – An AIMD analysis},
	url = {https://m2.mtmt.hu/api/publication/30777661},
	author = {Bakó, Imre and Daru, János and Pothoczki, Szilvia and Pusztai, László and Hermansson, K.},
	doi = {10.1016/j.molliq.2019.111579},
	journal-iso = {J MOL LIQ},
	journal = {JOURNAL OF MOLECULAR LIQUIDS},
	volume = {293},
	unique-id = {30777661},
	issn = {0167-7322},
	year = {2019},
	eissn = {1873-3166},
	orcid-numbers = {Daru, János/0000-0002-5630-6311}
}

@article{MTMT:30710353,
	title = {Mechanism of Heterolytic Hydrogen Splitting by Frustrated Lewis Pairs: Comparison of Static and Dynamic Models},
	url = {https://m2.mtmt.hu/api/publication/30710353},
	author = {Daru, János and Bakó, Imre and Stirling, András and Pápai, Imre},
	doi = {10.1021/acscatal.9b01137},
	journal-iso = {ACS CATAL},
	journal = {ACS CATALYSIS},
	volume = {9},
	unique-id = {30710353},
	issn = {2155-5435},
	year = {2019},
	eissn = {2155-5435},
	pages = {6049-6057},
	orcid-numbers = {Daru, János/0000-0002-5630-6311}
}

@article{MTMT:3114368,
	title = {Study of Lewis Acid Accelerated Palladium Catalyzed C-H Activation},
	url = {https://m2.mtmt.hu/api/publication/3114368},
	author = {Tischler, Orsolya and Kovács, Szabolcs and Érsek, Gábor and Králln, Péter and Daru, János and Stirling, András and Novák, Zoltán},
	doi = {10.1016/j.molcata.2016.09.018},
	journal-iso = {J MOL CATAL A-CHEM},
	journal = {JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL},
	volume = {426},
	unique-id = {3114368},
	issn = {1381-1169},
	abstract = {Abstract Acceleration of palladium catalyzed C-H activation by various Lewis Acids was demonstrated on the directed ortho-alkenylation and acylation of acetanilide and urea derivatives. The universality of this effect was investigated by the study of different palladium catalysts, directing groups in the aromatic substrates and versatile Lewis acids. Experiments were carried out to monitor the reactions and to compare the behavior and activity of different types of Lewis acids. Kinetic investigation revealed a rate determining C-H activation step, and DFT studies were performed for the explanation of Lewis acid effect on C-H activation.},
	keywords = {PALLADIUM; Lewis acid; DFT studies; C‐H activation},
	year = {2017},
	eissn = {1873-314X},
	pages = {444-450},
	orcid-numbers = {Kovács, Szabolcs/0000-0001-8768-5425; Daru, János/0000-0002-5630-6311; Novák, Zoltán/0000-0001-5525-3070}
}

@mastersthesis{MTMT:2957298,
	title = {Theoretical investigation of reaction mechanism - from methodological development to applications},
	url = {https://m2.mtmt.hu/api/publication/2957298},
	author = {Daru, János},
	doi = {10.15476/ELTE.2015.029},
	publisher = {Eötvös Loránd University},
	unique-id = {2957298},
	keywords = {reakciómechanizmus; kémia doktori disszertáció},
	year = {2015},
	orcid-numbers = {Daru, János/0000-0002-5630-6311}
}