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| Personal data sheet |
 Print previewpersonal data approved: 2023. IX. 10. | Publications |
2022
 from data base, 2023. IX. 10. |
Daru János, Forbert Harald, Behler Jörg, Marx Dominik: Coupled Cluster Molecular Dynamics of Condensed Phase Systems Enabled by Machine Learning Potentials: Liquid Water Benchmark, PHYSICAL REVIEW LETTERS 129: (22) 226001
type of document: Journal paper/Article
number of independent citations: 2
language: English
URL |
2021
from data base, 2023. IX. 10. |
Novák Zoltán, Adamik Réka, Csenki János T., Béke Ferenc, Gavaldik Regina, Varga Bálint, Nagy Bálint, May Zoltán, Daru János, Gonda Zsombor, Tolnai Gergely L.: Revisiting the amine-catalysed cross-coupling, NATURE CATALYSIS 4: pp. 991-993.
type of document: Journal paper/Article
number of independent citations: 8
language: English
URL |
2021
from data base, 2023. IX. 10. |
Thomas J., Bertram C., Daru J., Patwari J., Langguth I., Zhou P., Marx D., Morgenstern K., Bovensiepen U.: Competition between Coulomb and van der Waals Interactions in Xe − Cs + Aggregates on Cu(111) Surfaces, PHYSICAL REVIEW LETTERS 127: (26) 266802
type of document: Journal paper/Article
number of independent citations: 1
language: English
URL |
2019
from data base, 2023. IX. 10. |
Daru János, Bakó Imre, Stirling András, Pápai Imre: Mechanism of Heterolytic Hydrogen Splitting by Frustrated Lewis Pairs: Comparison of Static and Dynamic Models, ACS CATALYSIS 9: pp. 6049-6057.
type of document: Journal paper/Article
number of independent citations: 19
language: English
URL |
2019
from data base, 2023. IX. 10. |
Daru János, Gupta Prashant Kumar, Marx Dominik: Restricting Solvation to Two Dimensions: Soft Landing of Microsolvated Ions on Inert Surfaces, JOURNAL OF PHYSICAL CHEMISTRY LETTERS 10: (4) pp. 831-835.
type of document: Journal paper/Article
language: English
URL |
2015
from data base, 2023. IX. 10. |
Tolnai GL, Székely A, Makó Z, Gáti T, Daru J, Bihari T, Stirling A, Novák Z: Efficient direct 2,2,2-trifluoroethylation of indoles via C-H functionalization, CHEMICAL COMMUNICATIONS 51: (21) pp. 4488-4491.
type of document: Journal paper/Article
number of independent citations: 49
language: English
URL |
2014
from data base, 2023. IX. 10. |
Daru J, Stirling A: Divided saddle theory: A new idea for rate constant calculation, JOURNAL OF CHEMICAL THEORY AND COMPUTATION 10: (3) pp. 1121-1127.
type of document: Journal paper/Article
number of independent citations: 11
language: English
URL |
2014
from data base, 2023. IX. 10. |
Daru J, Benda Z, Póti A, Novák Z, Stirling A: Mechanistic study of silver-mediated furan formation by oxidative coupling, CHEMISTRY-A EUROPEAN JOURNAL 20: (47) pp. 15395-15400.
type of document: Journal paper/Article
number of independent citations: 31
language: English
URL |
2013
from data base, 2023. IX. 10. |
Szabó Fruzsina, Daru János, Simkó Dániel, Nagy Tibor Zs, Stirling András, Novák Zoltán: Mild Palladium-Catalyzed Oxidative Direct ortho-C-H Acylation of Anilides under Aqueous Conditions, ADVANCED SYNTHESIS & CATALYSIS 355: (4) pp. 685-691.
type of document: Journal paper/Article
number of independent citations: 69
language: English
URL |
2011
from data base, 2023. IX. 10. |
Daru J, Stirling A: Mechanism of the Pechmann Reaction: A Theoretical Study, JOURNAL OF ORGANIC CHEMISTRY 76: (21) pp. 8749-8755.
type of document: Journal paper/Article
number of independent citations: 46
language: English
URL |
| | Number of independent citations to these publications: | 236 |
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