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Comparison of different hybrid DFT methods on structural, spectroscopic, electronic and NLO parameters for a potential NLO material
Sumeyye Alturk
;
Avcı, Davut
;
Tamer, Ömer
;
Atalay, Yusuf
(
ELSEVIER SCIENCE BV
,
2017
)
Structural, spectroscopic, nonlinear optical and electronic properties of calcium N-phthaloylglycinate: A combined experimental and theoretical study
Tamer, Ömer
;
Avcı, Davut
;
Atalay, Yusuf
(
ELSEVIER SCIENCE BV
,
2016
)
Structural, electronic, optical, vibrational and transport properties of CuBX2 (X = S, Se, Te) chalcopyrites
Bağcı, Sadık
;
Yalçın, Battal Gazi
;
H. A. Rahnamaye Aliabad
;
Duman, Sıtkı
;
B. Salmankurt
(
ROYAL SOC CHEMISTRY
,
2016
)
Synthesis, molecular structure, spectral analysis and nonlinear optical studies on 4-(4-bromophenyl)-1-tert-butyl-3-methyl-1H-pyrazol-5-amine: A combined experimental and DFT approach
Tamer, Ömer
;
Baris Seckin Arslan
;
Avcı, Davut
;
Nebioğlu, Mehmet
;
Atalay, Yusuf
;
Bunyemin Cosut
(
ELSEVIER SCIENCE BV
,
2016
)
Characterisation of 1,3-diammonium propylselenate monohydrate by XRD, FT-IR, FT-Raman, DSC and DFT studies
S. Thirunarayanan
;
V. Arjunan
;
M. K. Marchewka
;
S. Mohan
;
Atalay, Yusuf
(
ELSEVIER SCIENCE BV
,
2016
)
Synthesis, X-ray structure, spectroscopic characterization and nonlinear optical properties of triaqua(1,10-phenanthroline-2,9-dicarboxylato)manganese(II) dihydrate: A combined experimental and theoretical study
Tamer, Ömer
;
Avcı, Davut
;
Atalay, Yusuf
;
Bunyemin Cosut
;
Yunus Zorlu
;
Erkovan, Mustafa
;
Yusuf Yerli
(
ELSEVIER
,
2015
)
Synthesis, spectroscopic characterization, second and third-order nonlinear optical properties, and DFT calculations of a novel Mn(II) complex
Tamer, Ömer
;
Avcı, Davut
;
Atalay, Yusuf
(
ELSEVIER SCIENCE SA
,
2015
)
Synthesis, X-ray structure, spectroscopic characterization and nonlinear optical properties of Nickel (II) complex with picolinate: A combined experimental and theoretical study
Tamer, Ömer
;
Avcı, Davut
;
Atalay, Yusuf
(
ELSEVIER
,
2015
)
NLO and NBO Analysis of Sarcosine-Maleic Acid by Using HF and B3LYP Calculations
Avcı, Davut
;
Atalay, Yusuf
(
HINDAWI LTD
,
2013
)
SPECTROSCOPIC STUDY, NLO PROPERTIES AND HOMO-LUMO ANALYSIS ON DIFFERENT DONOR AND ACCEPTOR SUBSTITUENTS OF THIAZOLYLAZOPYRIMIDINE CHROMOPHORES
Tamer, Ömer
;
Atalay, Yusuf
;
Avcı, Davut
(
WORLD SCIENTIFIC PUBL CO PTE LTD
,
2013
)
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