Items where Author is "Lendvay, György"

Article

Majzik, Eszter and Paiva Franguelli, Fernanda and Lendvay, György and Trif, László and Németh, Csaba and Farkas, Attila and Klébert, Szilvia and Nagyné Bereczki, Laura and Szilágyi, Imre Miklós and Kótai, László (2020) Deuteration and Vibrational Spectra of Dimethylammonium Paratungstate-B hydrates. ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE. ISSN 0044-2313

Novodárszki, Gyula and Solt, Hanna E. and Lendvay, György and R. Mihályi, Magdolna and Vikár, Anna and Lónyi, Ferenc and Hancsók, Jenő and Valyon, József (2019) Hydroconversion mechanism of biomass-derived γ-valerolactone. CATALYSIS TODAY, 336. pp. 50-62. ISSN 0920-5861

Nagy, Tibor and Vikár, Anna and Lendvay, György (2018) A general formulation of the quasiclassical trajectory method for reduced-dimensionality reaction dynamics calculations. Physical Chemistry Chemical Physics, 20 (19). pp. 13224-13240. ISSN 1463-9076

Miskolczy, Zsombor and Biczók, László and Lendvay, György (2018) Substituent effect on the dynamics of the inclusion complex formation between protoberberine alkaloids and cucurbit[7]uril. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 20. pp. 15986-15994. ISSN 1463-9076

Sajó, István E. and Bakos, László P. and Szilágyi, Imre M. and Lendvay, György and Magyari, József and Mohai, Miklós and Szegedi, Ágnes and Farkas, Attila and Jánosity, Anna and Klébert, Szilvia and Kótai, László (2018) Unexpected Sequential NH3 /H2O Solid/Gas Phase Ligand Exchange and Quasi-Intramolecular Self-Protonation Yield [NH4Cu(OH)MoO4], a Photocatalyst Misidentified before as (NH4)2 Cu(MoO4)2. INORGANIC CHEMISTRY, 57 (21). pp. 13679-13692. ISSN 0020-1669

Nagy, Tibor and Lendvay, György (2017) Adiabatic Switching Extended to Prepare Semiclassically Quantized Rotational-Vibrational Initial States for Quasiclassical Trajectory Calculations. JOURNAL OF PHYSICAL CHEMISTRY LETTERS. pp. 1-19. ISSN 1948-7185

Kovács, Ervin and Sághy, Péter and Turczel, Gábor and Tóth, Imre and Lendvay, György and Tuba, Róbert (2017) Metathesis o renewable polyene feedstocks - Indirect evidences of the formation of catalytically active ruthenium allylidene species. JOURNAL OF ORGANOMETALLIC CHEMISTRY, 847. pp. 213-217. ISSN 0022-328X

Lahankar, Sridhar A. and Zhang, Jianming and Minton, Timothy K. and Guo, Hua and Lendvay, György (2016) Dynamics of the O-Atom Exchange Reaction 16O(3P) + 18O18O(3Σ-g) -> 6O18O(3Σ-g) + 18O(3P) at Hyperthermal Energies. JOURNAL OF PHYSICAL CHEMISTRY A, 120. pp. 5348-5359. ISSN 1089-5639

Nagy, Tibor and Vikár, Anna and Lendvay, György (2016) Oscillatory reaction cross sections caused by normal mode sampling in quasiclassical trajectory calculations. JOURNAL OF CHEMICAL PHYSICS, 144 (1). pp. 1-33. ISSN 0021-9606

Fehér, Csaba and Papp, Máté and Gömöry, Ágnes and Nagy, Lívia and Wouters, Johan and Lendvay, György and Skodáné Földes, Rita (2016) Synthesis of 2-Ureido-4-ferrocenyl Pyrimidine Guests. Investigation of Complementary Molecular Recognition of 2,6-Diaminopyridine. ORGANOMETALLICS, 35 (24). pp. 4023-4032. ISSN 0276-7333

Vikár, Anna and Nagy, Tibor and Lendvay, György (2016) Testing the Palma-Clary Reduced Dimensionality Model Using Classical Mechanics on the CH4 + H -> CH3 + H2 Reaction. JOURNAL OF PHYSICAL CHEMISTRY A, 120 (27). pp. 5083-5093. ISSN 1089-5639

Szabó, Péter and Lendvay, György (2015) Dynamics of Complex-Forming Bimolecular Reactions: A Comparative Theoretical Study of the Reactions of H Atoms with O2(3Σg–) and O2(1Δg). JOURNAL OF PHYSICAL CHEMISTRY A, 119 (50). pp. 12485-12497. ISSN 1089-5639

Fiser, Béla and Jójárt, Balázs and Szőri, Milán and Lendvay, György and Csizmadia, Imre Gyula and Viskolcz, Béla (2015) Glutathione as a Prebiotic Answer to alpha-Peptide Based Life. JOURNAL OF PHYSICAL CHEMISTRY B, 119 (10). pp. 3940-3947. ISSN 1520-6106

Szabó, Péter and Lendvay, György (2015) A Quasiclassical Trajectory Study of the Reaction of H Atoms with O2(1Δg). JOURNAL OF PHYSICAL CHEMISTRY A, 2015. 10.1021/jp510202r. ISSN 1089-5639

Császár, Zs. and Farkas, Gergely and Bényei, Attila Csaba and Lendvay, György and Tóth, I. and Bakos, József (2015) Stereoselective coordination: a six-membered P,N-chelate tailored for asymmetric allylic alkylation. DALTON TRANSACTIONS, 44 (37). pp. 16352-16360. ISSN 1477-9226

Busch, Anna and González-García, Núria and Lendvay, György and Olzmann, Matthias (2015) Thermal Decomposition of NCN: Shock-Tube Study, Quantum Chemical Calculations, and Master-Equation Modeling. JOURNAL OF PHYSICAL CHEMISTRY A, 119 (28). pp. 1-31. ISSN 1089-5639

Busch, Anna and González-García, Núria and Lendvay, György and Olzmann, Matthias (2015) Thermal Decomposition of NCN: Shock-Tube Study, Quantum Chemical Calculations, and Master-Equation Modeling. JOURNAL OF PHYSICAL CHEMISTRY A, 119 (28). pp. 7838-7846. ISSN 1089-5639

Van Wyngarden, A. L. and Mar, K. A. and Quach, J. and Nguyen, A. P. Q. and Wiegel, A. A. and Lendvay, György (2014) The non-statistical dynamics of the (18)O+(32)O(2) isotope exchange reaction at two energies. JOURNAL OF CHEMICAL PHYSICS, 141 (6). No.-064311. ISSN 0021-9606

Demeter, Attila and Horváth, Klaudia and Böőr, Katalin and Molnár, Laura and Soós, Tibor and Lendvay, György (2013) Substituent Effect on the Photoreduction Kinetics of Benzophenone. JOURNAL OF PHYSICAL CHEMISTRY A, 117 (40). pp. 10196-10210. ISSN 1089-5639

Paizs, Béla and Szlávik, Z. and Lendvay, György and Vékey, Károly and Suhai, S. (2000) Formation of a2+ ions of protonated peptides. An ab intito study. RAPID COMMUNICATIONS IN MASS SPECTROMETRY, 14 (9). pp. 746-755. ISSN 0951-4198

Paizs, Béla and Lendvay, György and Vékey, Károly and Suhai, S. (1999) Formation of b2+ ions from protonated peptides: An ab initio study. RAPID COMMUNICATIONS IN MASS SPECTROMETRY, 13 (6). pp. 525-533. ISSN 0951-4198

Book Section

Lendvay, György (2019) Classical Trajectory Studies of Collisional Energy Transfer. In: Unimolecular Kinetics. Elsevier, pp. 109-272. ISBN 9780444642073

Lendvay, György and Schatz, George C. (2019) Quantum Scattering Theory for Collisional Energy Transfer. In: Unimolecular Kinetics. Elsevier, pp. 63-107. ISBN 9780444642073

Vikár, Anna and Nagy, Tibor and Lendvay, György (2015) Reduced-dimensionality study of the reaction of methane with H atom. In: Proceedings of the European Combustion Meeting. Magyar Égéstudományi Bizottság, Budapest, P1-19.

Szabó, Péter and Lendvay, György (2015) A comparative study of the kinetics and dynamics of the reaction of H atoms with ground-state and exctied O2. In: Proceedings of the European Combustion Meeting. Magyar Égéstudományi Bizottság, Budapest, P1-17.

Goos, Elke and Lendvay, György (2013) Calculation of molecular thermochemical data and their availability in databases. In: Cleaner Combustion: Developing Detailed Chemical Kinetic Models. Springer, London, pp. 515-547. ISBN 978-1-4471-5306-1

Monograph

Mayer, István and Lendvay, György (2013) Lokális tulajdonságok kvantumkémiai analízise és számítása = Quantum chemical analysis and computation of local properties. Project Report. OTKA.

Lendvay, György and Bencsura, Ákos and Bene, Erika (2009) Elemi reakciók dinamikájának és kinetikájának elméleti vizsgálata = Theoretical studies of the dynamics and kinetics of elementary reactions. Project Report. OTKA.

Mayer, István and Hamza, Andrea and Lendvay, György (2008) Energiakomponensek számítása molekulákban és reagáló rendszerekben = Calculation of energy components in molecules and in reacting systems. Project Report. OTKA.