• 1709 Citations
  • 26 h-Index
19992019
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Research Output 1999 2019

  • 1709 Citations
  • 26 h-Index
  • 77 Article
  • 2 Chapter
  • 1 Comment/debate
  • 1 Editorial
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Article
2019

Directed Gas-Phase Formation of the Germaniumsilylene Butterfly Molecule (Ge(μ-H 2 )Si)

Thomas, A. M., Dangi, B. B., Yang, T., Tarczay, G., Kaiser, R. I., Sun, B. J., Chen, S. Y., Chang, A. H. H., Nguyen, T. L., Stanton, J. F. & Mebel, A. M., Mar 21 2019, In : Journal of Physical Chemistry Letters. 10, 6, p. 1264-1271 8 p.

Research output: Contribution to journalArticle

Germanium
Silicon
germanium
Gases
vapor phases
5 Citations (Scopus)

Hydrogen Abstraction/Addition Tunneling Reactions Elucidate the Interstellar H2NCHO/HNCO Ratio and H2 Formation

Haupa, K. A., Tarczay, G. & Lee, Y. P., Jan 1 2019, In : Journal of the American Chemical Society. 141, 29, p. 11614-11620 7 p.

Research output: Contribution to journalArticle

Hydrogen
Addition reactions
Deuterium
Ice
Amides
1 Citation (Scopus)

S-H rotamerization: Via tunneling in a thiol form of thioacetamide

Góbi, S., Nunes, C. M., Reva, I., Tarczay, G. & Fausto, R., Jan 1 2019, In : Physical Chemistry Chemical Physics. 21, 31, p. 17063-17071 9 p.

Research output: Contribution to journalArticle

Thioacetamide
Sulfhydryl Compounds
thiols
half life
Thiones
1 Citation (Scopus)
Thiadiazoles
Sulfides
Spectroscopy
Decomposition
Nitriles
2018

Direction-dependent secondary bonds and their stepwise melting in a uracil-based molecular crystal studied by infrared spectroscopy and theoretical modeling

Szekrényes, Z., Nagy, P. R., Tarczay, G., Maggini, L., Bonifazi, D. & Kamarás, K., Jan 1 2018, In : Chemical Physics Letters. 691, p. 163-168 6 p.

Research output: Contribution to journalArticle

Molecular crystals
uracil
Uracil
Benzene
Infrared spectroscopy
Depsipeptides
Circular dichroism spectroscopy
Vibrational spectroscopy
dichroism
peptides
4 Citations (Scopus)

Near-infrared in situ generation of the higher-energy trans conformer of tribromoacetic acid: Observation of a large-scale matrix-site changing mediated by conformational conversion

Apóstolo, R. F. G., Bazsó, G., Ogruc-Ildiz, G., Tarczay, G. & Fausto, R., Jan 28 2018, In : Journal of Chemical Physics. 148, 4, 044303.

Research output: Contribution to journalArticle

Infrared radiation
acids
matrices
energy
Molecules
4 Citations (Scopus)

Photochemical Formation of Diazenecarbaldehyde (HNNCHO) and Diazenecarbothialdehyde (HNNCHS) in Low-Temperature Matrices

Vörös, T., Lajgút, G. G., Magyarfalvi, G. & Tarczay, G., Feb 1 2018, In : Journal of Physical Chemistry A. 122, 4, p. 1034-1044 11 p.

Research output: Contribution to journalArticle

diamines
Oxadiazoles
Diamines
matrices
Thiadiazoles
2017
5 Citations (Scopus)
Covalent bonds
covalent bonds
Irradiation
Dicarboxylic Acids
acids
4 Citations (Scopus)

Synthesis of the Smallest Member of the Silylketene Family: H3SiC(H)=C=O

Tarczay, G., Förstel, M., Góbi, S., Maksyutenko, P. & Kaiser, R. I., 2017, (Accepted/In press) In : ChemPhysChem.

Research output: Contribution to journalArticle

Silanes
silanes
Ice
Silicon
synthesis
2016
7 Citations (Scopus)

Formation of Higher Silanes in Low-Temperature Silane (SiH4) Ices

Tarczay, G., Förstel, M., Maksyutenko, P. & Kaiser, R. I., Sep 6 2016, In : Inorganic Chemistry. 55, 17, p. 8776-8785 10 p.

Research output: Contribution to journalArticle

Silanes
Ice
silanes
ice
Temperature
5 Citations (Scopus)
Infrared lasers
Laser beam effects
glycine
infrared lasers
Glycine
8 Citations (Scopus)

The first experimental observation of the higher-energy trans conformer of trifluoroacetic acid

Apóstolo, R. F. G., Bazsó, G., Bento, R. R. F., Tarczay, G. & Fausto, R., Dec 5 2016, In : Journal of Molecular Structure. 1125, p. 288-295 8 p.

Research output: Contribution to journalArticle

Trifluoroacetic Acid
Infrared radiation
Quantum chemistry
Potential energy surfaces
Fluorine
2015
3 Citations (Scopus)

Generation and spectroscopic identification of NCXNC and NCNCX (X = S, Se) in low-temperature inert matrices

Vörös, T., Pacsai, B., Magyarfalvi, G. & Tarczay, G., Jun 15 2015, In : Journal of Molecular Spectroscopy. 316, p. 95-104 10 p.

Research output: Contribution to journalArticle

Isomers
isomers
matrices
isolation
Excitation energy
17 Citations (Scopus)

Identification of Serine Conformers by Matrix-Isolation IR Spectroscopy Aided by Near-Infrared Laser-Induced Conformational Change, 2D Correlation Analysis, and Quantum Mechanical Anharmonic Computations

Najbauer, E. E., Bazsó, G., Apóstolo, R., Fausto, R., Biczysko, M., Barone, V. & Tarczay, G., Aug 20 2015, In : Journal of Physical Chemistry B. 119, 33, p. 10496-10510 15 p.

Research output: Contribution to journalArticle

Infrared lasers
infrared lasers
Serine
Infrared spectroscopy
isolation
5 Citations (Scopus)

Near-infrared laser-induced structural changes of glycine·water complexes in an ar matrix

Kócs, L., Najbauer, E. E., Bazsó, G., Magyarfalvi, G. & Tarczay, G., Mar 19 2015, In : Journal of Physical Chemistry A. 119, 11, p. 2429-2437 9 p.

Research output: Contribution to journalArticle

Infrared lasers
infrared lasers
Stretching
Laser beam effects
matrices
3 Citations (Scopus)

On the FCNS ⇄ FC(NS) reaction: A matrix isolation and theoretical study

Tajti, A., Mück, L. A., Farkas, Á. L., Krebsz, M., Pasinszki, T., Tarczay, G. & Szalay, P., Apr 1 2015, In : Journal of Molecular Spectroscopy. 310, p. 8-15 8 p.

Research output: Contribution to journalArticle

isolation
intersections
Excitation energy
rings
matrices
4 Citations (Scopus)

VCD Robustness of the Amide-I and Amide-II Vibrational Modes of Small Peptide Models

Gõbi, S., Magyarfalvi, G. & Tarczay, G., Sep 1 2015, In : Chirality. 27, 9, p. 625-634 10 p.

Research output: Contribution to journalArticle

Circular Dichroism
Amides
Peptides
Conformations
Chirality
2014
15 Citations (Scopus)

Exploring the conformational space of cysteine by matrix isolation spectroscopy combined with near-infrared laser induced conformational change

Najbauer, E. E., Bazsó, G., Góbi, S., Magyarfalvi, G. & Tarczay, G., Feb 27 2014, In : Journal of Physical Chemistry B. 118, 8, p. 2093-2103 11 p.

Research output: Contribution to journalArticle

Infrared lasers
cysteine
Microwave spectroscopy
infrared lasers
Cysteine
19 Citations (Scopus)

Interactions and chemical transformations of coronene inside and outside carbon nanotubes

Botka, B., Füstös, M. E., Tõháti, H. M., Németh, K., Klupp, G., Szekrényes, Z., Kocsis, D., Utczás, M., Székely, E., Váczi, T., Tarczay, G., Hackl, R., Chamberlain, T. W., Khlobystov, A. N. & Kamarás, K., Apr 9 2014, In : Small. 10, 7, p. 1369-1378 10 p.

Research output: Contribution to journalArticle

Carbon Nanotubes
Nanotubes
Carbon nanotubes
Molecules
Carbon
2013
7 Citations (Scopus)

Foldamers of β-peptides: Conformational preference of peptides formed by rigid building blocks. the first MI-IR spectra of a triamide nanosystem

Pohl, G., Gorrea, E., Branchadell, V., Ortuño, R. M., Perczel, A. & Tarczay, G., 2013, In : Amino Acids. 45, 4, p. 957-973 17 p.

Research output: Contribution to journalArticle

Nanosystems
Chirality
Noble Gases
Oligopeptides
Peptides
7 Citations (Scopus)

Generation and spectroscopic identification of ClCNS, ClNCS and NCCNS

Krebsz, M., Tarczay, G. & Pasinszki, T., Dec 9 2013, In : Chemistry - A European Journal. 19, 50, p. 17201-17208 8 p.

Research output: Contribution to journalArticle

Thiadiazoles
Chlorine
Sulfides
Photolysis
Argon
6 Citations (Scopus)

Matrix isolation and computational study of the [H, C, N, Se] isomers

Vörös, T., Bazsó, G. & Tarczay, G., Dec 19 2013, In : Journal of Physical Chemistry A. 117, 50, p. 13616-13625 10 p.

Research output: Contribution to journalArticle

Isomers
isolation
isomers
matrices
Potential energy surfaces
46 Citations (Scopus)

Near-infrared laser induced conformational change of alanine in low-temperature matrixes and the tunneling lifetime of its conformer VI

Bazsó, G., Najbauer, E. E., Magyarfalvi, G. & Tarczay, G., Mar 7 2013, In : Journal of Physical Chemistry A. 117, 9, p. 1952-1962 11 p.

Research output: Contribution to journalArticle

Infrared lasers
alanine
Alanine
infrared lasers
Irradiation
15 Citations (Scopus)
Isocyanates
Azides
Argon
Photolysis
Ethane
2012
9 Citations (Scopus)

Generation and spectroscopic identification of selenofulminic acid and its methyl and cyano derivatives (XCNSe, X=H, CH 3, NC)

Krebsz, M., Májusi, G., Pacsai, B., Tarczay, G. & Pasinszki, T., Feb 27 2012, In : Chemistry - A European Journal. 18, 9, p. 2646-2652 7 p.

Research output: Contribution to journalArticle

Nitriles
Ultraviolet spectroscopy
Argon
Infrared spectroscopy
Derivatives
3 Citations (Scopus)
Isomers
Shells (structures)
Noble Gases
Excitation energy
Photolysis
7 Citations (Scopus)

Melting of hydrogen bonds in uracil derivatives probed by infrared spectroscopy and ab initio molecular dynamics

Szekrényes, Z., Kamarás, K., Tarczay, G., Llanes-Pallás, A., Marangoni, T., Prato, M., Bonifazi, D., Björk, J., Hanke, F. & Persson, M., Apr 19 2012, In : Journal of Physical Chemistry B. 116, 15, p. 4626-4633 8 p.

Research output: Contribution to journalArticle

uracil
Uracil
Molecular dynamics
Infrared spectroscopy
Hydrogen bonds
35 Citations (Scopus)
Infrared lasers
Photolysis
Glycine
Lasers
Stretching
26 Citations (Scopus)

Near-infrared radiation induced conformational change and hydrogen atom tunneling of 2-chloropropionic acid in low-temperature Ar matrix

Bazsó, G., Góbi, S. & Tarczay, G., May 24 2012, In : Journal of Physical Chemistry A. 116, 20, p. 4823-4832 10 p.

Research output: Contribution to journalArticle

near infrared radiation
Hydrogen
hydrogen atoms
Infrared radiation
Atoms
53 Citations (Scopus)

Tunneling lifetime of the ttc /VIp conformer of glycine in low-temperature matrices

Bazsó, G., Magyarfalvi, G. & Tarczay, G., Nov 1 2012, In : Journal of Physical Chemistry A. 116, 43, p. 10539-10547 9 p.

Research output: Contribution to journalArticle

glycine
Glycine
life (durability)
matrices
formic acid
2011
28 Citations (Scopus)

Effects of strong and weak hydrogen bond formation on VCD spectra: A case study of 2-chloropropionic acid

Góbi, S., Vass, E., Magyarfalvi, G. & Tarczay, G., Aug 21 2011, In : Physical Chemistry Chemical Physics. 13, 31, p. 13972-13984 13 p.

Research output: Contribution to journalArticle

dichroism
Hydrogen bonds
Dimers
hydrogen bonds
acids
42 Citations (Scopus)

Gas-phase and Ar-Matrix SQM scaling factors for various DFT functionals with basis sets including polarization and diffuse functions

Fábri, C., Szidarovszky, T., Magyarfalvi, G. & Tarczay, G., May 12 2011, In : Journal of Physical Chemistry A. 115, 18, p. 4640-4649 10 p.

Research output: Contribution to journalArticle

Discrete Fourier transforms
functionals
Gases
Polarization
vapor phases
61 Citations (Scopus)
Correlation theory
Electron correlations
Argon
Cytosine
tautomers
47 Citations (Scopus)

Vibrational circular dichroism

Magyarfalvi, G., Tarczay, G. & Vass, E., May 2011, In : Wiley Interdisciplinary Reviews: Computational Molecular Science. 1, 3, p. 403-425 23 p.

Research output: Contribution to journalArticle

Circular Dichroism
dichroism
Spectroscopy
Circular dichroism spectroscopy
Vibrational spectroscopy
2010
9 Citations (Scopus)

First-principles calculation of electron spin-rotation tensors

Tarczay, G., Szalay, P. & Gauss, J., Sep 2 2010, In : Journal of Physical Chemistry A. 114, 34, p. 9246-9252 7 p.

Research output: Contribution to journalArticle

electron spin
Tensors
tensors
Hamiltonians
Electron correlations
14 Citations (Scopus)
Proline
Cryogenics
dichroism
cryogenics
peptides
15 Citations (Scopus)

Structure, stability, and generation of CH3CNS

Krebsz, M., Hajgató, B., Bazsó, G., Tarczay, G. & Pasinszki, T., 2010, In : Australian Journal of Chemistry. 63, 12, p. 1686-1693 8 p.

Research output: Contribution to journalArticle

Irradiation
Sulfur
Thiadiazoles
Atoms
Molecules
2009
16 Citations (Scopus)

A matrix isolation and computational study of the [C, N, F, S] isomers

Pasinszki, T., Bazsó, G., Krebsz, M. & Tarczay, G., 2009, In : Physical Chemistry Chemical Physics. 11, 41, p. 9458-9467 10 p.

Research output: Contribution to journalArticle

Potential energy surfaces
Isomers
isolation
isomers
potential energy
15 Citations (Scopus)
Peptides
peptides
isolation
matrices
Conformations
22 Citations (Scopus)

First isolation and spectroscopic observation of thiofulminic acid (HCNS)

Pasinszki, T., Krebsz, M., Bazsó, G. & Tarczay, G., Jun 15 2009, In : Chemistry - A European Journal. 15, 25, p. 6100-6102 3 p.

Research output: Contribution to journalArticle

Sulfides
Nitriles
Cryogenics
Acids
Thiadiazoles
16 Citations (Scopus)
Chirality
Complexation
Conformations
Peptides
Water
2008
2 Citations (Scopus)
thermochemical properties
Physical chemistry
physical chemistry
Physics
physics
19 Citations (Scopus)
Proline
Diamide
Peptides
Energy barriers
Bioactivity
13 Citations (Scopus)
Jahn-Teller effect
Electronic states
Potential energy surfaces
Vibrational spectra
electronics
17 Citations (Scopus)
Jahn-Teller effect
Electronic states
Fluorescence
fluorescence
laser induced fluorescence
2007
45 Citations (Scopus)
peptides
isolation
proteins
Infrared absorption
Peptides
18 Citations (Scopus)

Conformers and photochemistry of propyl nitrites: A matrix isolation study

Mat́yus, E., Magyarfalvi, G. & Tarczay, G., Jan 25 2007, In : Journal of Physical Chemistry A. 111, 3, p. 450-459 10 p.

Research output: Contribution to journalArticle

Photochemical reactions
nitrites
Nitrites
photochemical reactions
isolation
26 Citations (Scopus)

Investigation of ethyl peroxy radical conformers via cavity ringdown spectroscopy of the Ã-X̃ electronic transition

Rupper, P., Sharp, E. N., Tarczay, G. & Miller, T. A., Feb 8 2007, In : Journal of Physical Chemistry A. 111, 5, p. 832-840 9 p.

Research output: Contribution to journalArticle

Equations of motion
Spectroscopy
cavities
electronics
spectroscopy
2006
39 Citations (Scopus)
Circular dichroism spectroscopy
Vibrational spectroscopy
Propanol
Hydrogen bonds
Molecules