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Showing 9 out of a total of 89 results for community: Fen-Edebiyat Fakültesi.
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DFT Calculations on the Molecular Structure, Vibrational and Chemical Shift Assignments of 4-Allyl-2-(morpholin-4-ylmethyl)-5-(pyridin-4-yl)-2, 4-Dihydro-3H-1,2,4-Triazole-3-Thione
Avcı, Davut
;
Atalay, Yusuf
;
Cömert, Hüseyin
(
SPRINGER HEIDELBERG
,
2011
)
Structural and Spectroscopic Characterization of 1-(5-Brornothiophen-2-yl)-3-(4-nitrophenyl)prop-2-en-1-one: An Analysis of Electronic and NLO Properties
Tamer, Ömer
;
Avcı, Davut
;
Atalay, Yusuf
(
POLISH ACAD SCIENCES INST PHYSICS
,
2014
)
Theoretical Investigation of N-Methyl-N '-(4-nitrobenzylidene) pyrazine-2-carbohydrazide: Conformational Study, NBO Analysis, Molecular Structure and NMR Spectra
N. Gunay
;
Tamer, Ömer
;
D. Kuzalic
;
Avcı, Davut
;
Atalay, Yusuf
(
POLISH ACAD SCIENCES INST PHYSICS
,
2015
)
Synthesis, crystal structure, spectroscopic characterization and nonlinear optical properties of Co(II)- picolinate complex
Tamer, Ömer
;
Avcı, Davut
;
Atalay, Yusuf
(
ELSEVIER SCIENCE SA
,
2015
)
Effects of Different Basis Sets and Donor-Acceptor Groups on Linear and Second-Order Nonlinear Optical Properties and Molecular Frontier Orbital Energies
Avcı, Davut
;
Başoğlu, Adil
;
Atalay, Yusuf
(
WILEY-BLACKWELL
,
2011
)
Novel D-pi-A organic dyes for DSSCs based on dibenzo[b,h] [1,6] naphthyridine as a pi-bridge
Barn Seckin Arslan
;
Güzel, Emre
;
Tugba Kaya
;
Veysel Durmaz
;
Merve Keskin
;
Avcı, Davut
;
Nebioğlu, Mehmet
;
Şişman, İlkay
;
Ilkay Sisman
(
ELSEVIER SCI LTD
,
2019
)
Novel Cu(II), Co(II) and Zn(II) metal complexes with mixed-ligand: Synthesis, crystal structure, alpha-glucosidase inhibition, DFT calculations, and molecular docking
Avcı, Davut
;
Sumeyye Alturk
;
Fatih Sonmez
;
Tamer, Ömer
;
Başoğlu, Adil
;
Atalay, Yusuf
;
Belma Zengin Kurt
;
Necmi Dege
(
ELSEVIER
,
2019
)
Synthesis, crystal structure, photophysical properties, density functional theory calculations and molecular docking studies on Cd(II) complex of 4,4 '-dimethyl-2,2 '-dipyridyl
Tamer, Ömer
;
Avcı, Davut
;
Necmi Dege
;
Atalay, Yusuf
(
ELSEVIER
,
2020
)
A heterocyclic compound 5-acetyl-2,4-dimethylthiazole, spectroscopic, natural bond orbital, nonlinear optical and molecular docking studies
Avcı, Davut
;
B. Dede
;
S. Bahceli
;
D. Varkal
(
SOC MEXICANA FISICA
,
2019
)
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Avcı, Davut (89)
Atalay, Yusuf (78)
Tamer, Ömer (67)
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4-methoxybenzaldehyde-N-methyl-4-stilbazolium tosylate; spectroscopic and structural properties; natural bond orbital analysis; nonlinear optical parameters; Hartree-Fock and density functional theory calculations (2)
C-6 fluoroalkylated pyridine; potential energy scan; natural bonding orbital analysis; nonlinear optical properties; HF and DFT calculations (2)
Pharmacology & Pharmacy (2)
Polymer Science (2)
Science & Technology - Other Topics (2)
(E)-2-(((4-bromo-2-(trifluoromethoxy)phenyl)imino)methyl)-4-nitrophenol; Crystal structure; Vibrational spectroscopy; DFT calculations; NLO and NBO analysis (1)
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