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Ulrike Salzner
Ulrike Salzner
Zweryfikowany adres z fen.bilkent.edu.tr
Tytuł
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Cytowane przez
Rok
Tuned range-separated hybrids in density functional theory
R Baer, E Livshits, U Salzner
Annual review of physical chemistry 61, 85-109, 2010
7642010
Comparison of geometries and electronic structures of polyacetylene, polyborole, polycyclopentadiene, polypyrrole, polyfuran, polysilole, polyphosphole, polythiophene …
U Salzner, JB Lagowski, PG Pickup, RA Poirier
Synthetic Metals 96 (3), 177-189, 1998
4841998
Ab initio examination of anomeric effects in tetrahydropyrans, 1, 3-dioxanes, and glucose
U Salzner, PR Schleyer
The Journal of Organic Chemistry 59 (8), 2138-2155, 1994
2691994
Generalized anomeric effects and hyperconjugation in CH2 (OH) 2, CH2 (SH) 2, CH2 (SeH) 2, and CH2 (TeH) 2
U Salzner, PR Schleyer
Journal of the American Chemical Society 115 (22), 10231-10236, 1993
2301993
Improved prediction of properties of π-conjugated oligomers with range-separated hybrid density functionals
U Salzner, A Aydin
Journal of chemical theory and computation 7 (8), 2568-2583, 2011
2252011
Koopmans’ springs to life
U Salzner, R Baer
The Journal of chemical physics 131 (23), 2009
2232009
Accurate method for obtaining band gaps in conducting polymers using a DFT/hybrid approach
U Salzner, PG Pickup, RA Poirier, JB Lagowski
The Journal of Physical Chemistry A 102 (15), 2572-2578, 1998
1981998
Design of low band gap polymers employing density functional theory—hybrid functionals ameliorate band gap problem
U Salzner, JB Lagowski, PG Pickup, RA Poirier
Journal of computational chemistry 18 (15), 1943-1953, 1997
1981997
Does the Donor− Acceptor Concept Work for Designing Synthetic Metals? 1. Theoretical Investigation of Poly (3-cyano-3 ‘-hydroxybithiophene)
U Salzner
The Journal of Physical Chemistry B 106 (36), 9214-9220, 2002
942002
Electronic structure of conducting organic polymers: insights from time‐dependent density functional theory
U Salzner
Wiley Interdisciplinary Reviews: Computational Molecular Science 4 (6), 601-622, 2014
882014
Does the Donor− Acceptor Concept Work for Designing Synthetic Metals? 2. Theoretical Investigation of Copolymers of 4-(Dicyanomethylene)-4 H-cyclopenta [2, 1-b: 3, 4-b …
U Salzner, ME Köse
The Journal of Physical Chemistry B 106 (36), 9221-9226, 2002
882002
Origin of the anomeric effect revisited. Theoretical conformation analysis of 2-hydroxypiperidine and 2-hydroxyhexahydropyrimidine
U Salzner
The Journal of Organic Chemistry 60 (4), 986-995, 1995
771995
Conducting copolymers of pyridine with thiophene, N-methylpyrrole, and selenophene
IH Jenkins, U Salzner, PG Pickup
Chemistry of materials 8 (10), 2444-2450, 1996
721996
Use of side-chain for rational design of n-type diketopyrrolopyrrole-based conjugated polymers: what did we find out?
C Kanimozhi, N Yaacobi-Gross, EK Burnett, AL Briseno, TD Anthopoulos, ...
Physical Chemistry Chemical Physics 16 (32), 17253-17265, 2014
692014
Investigation of charge carriers in doped thiophene oligomers through theoretical modeling of their UV/Vis spectra
U Salzner
The Journal of Physical Chemistry A 112 (24), 5458-5466, 2008
652008
Quantitatively correct UV-vis spectrum of ferrocene with TDB3LYP
U Salzner
Journal of Chemical Theory and Computation 9 (9), 4064-4073, 2013
632013
Trends in molecular design strategies for ambient stable n-channel organic field effect transistors
J Dhar, U Salzner, S Patil
Journal of Materials Chemistry C 5 (30), 7404-7430, 2017
612017
Theoretical investigation of excited states of oligothiophenes and of their monocations
U Salzner
Journal of Chemical Theory and Computation 3 (3), 1143-1157, 2007
612007
Nature of charge carriers in long doped oligothiophenes: the effect of counterions
N Zamoshchik, U Salzner, M Bendikov
The Journal of Physical Chemistry C 112 (22), 8408-8418, 2008
592008
Does the donor–acceptor concept work for designing synthetic metals?
U Salzner, O Karaltı, S Durdaği
Journal of molecular modeling 12 (5), 687-701, 2006
572006
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