László Túri
László Túri
Professor of Chemistry, Eötvös Loránd University
E-mail megerősítve itt: chem.elte.hu
Cím
Hivatkozott rá
Hivatkozott rá
Év
Characterization of excess electrons in water-cluster anions by quantum simulations
L Turi, WS Sheu, PJ Rossky
Science 309 (5736), 914-917, 2005
283*2005
Characterization of excess electrons in water-cluster anions by quantum simulations
L Turi, WS Sheu, PJ Rossky
Science 309 (5736), 914-917, 2005
2762005
Correcting for basis set superposition error in aggregates containing more than two molecules: ambiguities in the calculation of the counterpoise correction
L Turi, JJ Dannenberg
The Journal of Physical Chemistry 97 (11), 2488-2490, 1993
2651993
Molecular orbital study of acetic acid aggregation. 1. Monomers and dimers
L Turi, JJ Dannenberg
The Journal of Physical Chemistry 97 (47), 12197-12204, 1993
1681993
Theoretical studies of spectroscopy and dynamics of hydrated electrons
L Turi, PJ Rossky
Chemical reviews 112 (11), 5641-5674, 2012
1592012
Analytical investigations of an electron–water molecule pseudopotential. II. Development of a new pair potential and molecular dynamics simulations
L Turi, D Borgis
The Journal of chemical physics 117 (13), 6186-6195, 2002
1592002
Molecular orbital studies of CH... O hydrogen-bonded complexes
L Turi, JJ Dannenberg
The Journal of Physical Chemistry 97 (30), 7899-7909, 1993
1521993
Comment on ''Does the Hydrated Electron Occupy a Cavity?''
L Turi, Á Madarász
Science 331, 1387, 2011
102*2011
Ab initio molecular orbital analysis of dimers of cis-formic acid. Implications for condensed phases
L Turi
The Journal of Physical Chemistry 100 (27), 11285-11291, 1996
941996
Acidity of hydroxamic acids: an ab initio and semiempirical study
ON Ventura, JB Rama, L Turi, JJ Dannenberg
Journal of the American Chemical Society 115 (13), 5754-5761, 1993
871993
Role of the C− H⊙⊙⊙ O Hydrogen Bonds in Liquids: A Monte Carlo Simulation Study of Liquid Formic Acid Using a Newly Developed Pair-Potential
P Jedlovszky, L Turi
The Journal of Physical Chemistry B 101 (27), 5429-5436, 1997
841997
Role of the C− H⊙⊙⊙ O Hydrogen Bonds in Liquids: A Monte Carlo Simulation Study of Liquid Formic Acid Using a Newly Developed Pair-Potential
P Jedlovszky, L Turi
The Journal of Physical Chemistry B 101 (27), 5429-5436, 1997
841997
Molecular orbital study of crystalline acetic Acid. 2. Aggregates in one, two, and three dimensions
L Turi, JJ Dannenberg
Journal of the American Chemical Society 116 (19), 8714-8721, 1994
831994
Proximity Effects on Nuclear Spin-Spin Coupling Constants. 1. J (CH) Couplings in the Vicinity of an Atom Bearing Lone Pairs
C Vizioli, MC Ruiz de Azúa, CG Giribet, RH Contreras, L Turi, ...
The Journal of Physical Chemistry 98 (36), 8858-8861, 1994
791994
Equilibrium structure, fluctuations, and spectroscopy of a solvated electron in methanol
L Turi, A Mosyak, PJ Rossky
The Journal of chemical physics 107 (6), 1970-1980, 1997
711997
Excess electron relaxation dynamics at water/air interfaces
Á Madarász, PJ Rossky, L Turi
The Journal of chemical physics 126 (23), 234707, 2007
662007
Analytical investigations of an electron–water molecule pseudopotential. I. Exact calculations on a model system
L Turi, MP Gaigeot, N Levy, D Borgis
The Journal of Chemical Physics 114 (18), 7805-7815, 2001
642001
Gas-phase structure and acidity of formohydroxamic acid and formamide: a comparative ab initio study
ON Ventura, JB Rama, L Turi, JJ Dannenberg
The Journal of Physical Chemistry 99 (1), 131-136, 1995
641995
Interior-and surface-bound excess electron states in large water cluster anions
Á Madarász, PJ Rossky, L Turi
The Journal of chemical physics 130 (12), 124319, 2009
632009
Excess electron localization sites in neutral water clusters
L Turi, Á Madarász, PJ Rossky
The Journal of chemical physics 125 (1), 014308, 2006
582006
A rendszer jelenleg nem tudja elvégezni a műveletet. Próbálkozzon újra később.
Cikkek 1–20