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1

A Standard Set of Pericyclic Reactions of Hydrocarbons for the Benchmarking of Computational Methods: The Performance of ab Initio, Density Functional, CASSCF, CASPT2, and CBS-QB3 Methods for the Prediction of Activation Barriers, Reaction Energetics, and Transition State Geometries

Guner, Vildan, Khuong, Kelli S., Leach, Andrew G., Lee, Patrick S., Bartberger, Michael D., Houk, K. N.

Journal:

Journal of Physical Chemistry A

Year:

2003

Language:

english

File:

PDF, 474 KB

english, 2003

2

The Performance of the Handy/Cohen Functionals, OLYP and O3LYP, for the Computation of Hydrocarbon Pericyclic Reaction Activation Barriers †

Guner, Vildan A., Khuong, Kelli S., Houk, K. N., Chuma, Anthony, Pulay, Peter

Journal:

Journal of Physical Chemistry A

Year:

2004

Language:

english

File:

PDF, 187 KB

english, 2004

3

Computational Studies on the Electrocyclizations of 1-Amino-1,3,5-hexatrienes

Guner, Vildan Adar, Houk, K. N., Davies, Ian W.

Journal:

Journal of Organic Chemistry

Year:

2004

Language:

english

File:

PDF, 218 KB

english, 2004

4

Theoretical Evidence for Oxygenated Intermediates in the Reductive Cyclization of Nitrobenzenes

Davies, Ian W., Guner, Vildan A., Houk, K. N.

Journal:

Organic Letters

Year:

2004

Language:

english

File:

PDF, 117 KB

english, 2004

5

Crystal Structure of 3,3-Dichloro-N-p-methoxyphenyl-4-(2-phenylstryl)-2-azetidinone

KABAK, Mehmet, GÜNER, Vildan, ELERMAN, Yalçin, DURLU, Tahsin N.

Journal:

Analytical Sciences

Year:

2003

Language:

english

File:

PDF, 142 KB

english, 2003

6

Synthesis and antimicrobial activity of 1,4-diaryl-2-azetidinones

Vıldan Güner, Süleyman Yıldırır, Berrın Özçelık, Ufuk Abbasoğlu

Journal:

Year:

2000

Language:

english

File:

PDF, 84 KB

english, 2000

7

Demonstrating the Synergy of Synthetic, Mechanistic, and Computational Studies in a Regioselective Aniline Synthesis

Davies, Ian W., Marcoux, Jean-François, Kuethe, Jeffery T., Lankshear, Michael D., Taylor, Jeremy D. O., Tsou, Nancy, Dormer, Peter G., Hughes, David L., Houk, K. N., Guner, Vildan

Journal:

Journal of Organic Chemistry

Year:

2004

Language:

english

File:

PDF, 281 KB

english, 2004

8

Diels−Alder Reactions of Cyclopentadiene and 9,10-Dimethylanthracene with Cyanoalkenes: The Performance of Density Functional Theory and Hartree−Fock Calculations for the Prediction of Substituent Effects †

Jones, Gavin O., Guner, Vildan A., Houk, K. N.

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 219 KB

english, 2006

9

INFRARED SPECTRA AND AM1 CALCULATIONS OF N-BENZYLIDENEANILINES

Güner, Vildan, Bayari, Sevgi

Journal:

Spectroscopy Letters

Year:

2002

Language:

english

File:

PDF, 369 KB

english, 2002

10

Crystal Structure of 3,3-Dichloro-N-p-methoxyphenyl-4-(2-phenylstrlyl)-2-azetidinone.

KABAK, Mehmet, GÜNER, Vildan, ELERMAN, Yalçin, DURLU, Tahsin N.

Journal:

Analytical Sciences

Year:

2001

Language:

english

File:

PDF, 126 KB

english, 2001

11

On Intuitionistic Fuzzy 2-Metric Spaces

Güner, Elif, Çetkin, Vildan, Aygün, Halis, Cattani, C., Atangana, A., Bulut, H., Hammouch, Z., Baskonus, H.M., Mekkaoui, T., Agoujil, S.

Journal:

ITM Web of Conferences

Year:

2018

Language:

english

File:

PDF, 302 KB

english, 2018

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