Experimental and DFT Study on Electronic and Optical Properties of Donor-Acceptor Type Copolymers Containing Thiophene (T), Thienothiophene (TT), Dithienothiophene (DTT) and Bithiazole (NBT) Units
” İstanbul International Organic Electronic Symposium, 2 Aralık 2019
SÜTAY BERKAY,YURTSEVER MİNE,CİCİGÜL HAKAN,TİFTİKÇİ ESRA,TOPAL SEBAHAT,ÖZTÜRK TURAN,SEZER ESMA,USTAMEHMETOĞLU BELKIZ
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A DFT Study on the Mechanism of Cyclopropanation via Cu acac Catalyzed Diazo Ester Decomposition
Organometallics, Vol. 27, No. 18, Eylül 2008, s. 4600-4610, ISSN: 0276-7333
ÖZEN CİHAN,TÜZÜN NURCAN
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A DFT Study on Electronic and Optical Properties of BTI-based Oligomers
International Symposium on Chemistry via Computation, İstanbul/TÜRKİYE, 30 Ekim 2017
ALİM ÇİSİL,SÜTAY BERKAY,ONARAN GÜLŞAH,YURTSEVER MİNE
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A new asymmetric phthalocyanine-based chemosensor for the detection of ultra trace amount of copper (II) ions in environmental samples: comprehensive complex characterization and DFT analysis
Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, Vol. 346, Şubat 2026, ISSN: 1386-1425
YAVUZ ÖZGÜR,YILDIZ BURAK,AHMETALİ EREM,ARIBUĞA HÜLYA,ERTUĞRAL UTKU,KURA BERKEHAN,TÜZÜN NURCAN,ŞENER MUHAMMET KASIM,YILMAZ İSMAİL
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A DFT Study on the Stereoselective Propagation in Free Radical Polymerization of Acrylamides
46. IUPAC World Congress, 17 Temmuz 2016
TÜZÜN NURCAN,KAYIK GÜLRU
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Non-peripherally substituted metallophthalocyanines catalyzed diastereoselective carbonyl-ylide reactions: Synthesis and DFT calculations
TETRAHEDRON, Vol. 80, Ocak 2021, ISSN: 0040-4020
GÜNGÖR FÜSUN ŞEYMA, SESALAN BEHİCE ŞEBNEM, ŞENYURT TÜZÜN NURCAN, ÖZKILIÇ YILMAZ, ANAÇ OLCAY
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Efficient Computation of DFT Commuting Matrices by a Closed Form Infinite Order Approximation to the Second Differentiation Matrix
Signal Processing, Vol. 91, No. 3, Mart 2011, s. 582-589
SERBES AHMET,DURAK ATA LÜTFİYE
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Cyclopolymerization Reactions of Diallyl Monomers Exploring Electronic and Steric Effects Using DFT Reactivity Indices
The Journal of Physical Chemistry A, Vol. 113, No. 30, Temmuz 2009, s. 8704-8711, ISSN: 1089-5639
UĞUR İLKE,VLEESCHOUWER FREİJA DE,TÜZÜN NURCAN,AVİYENTE VİKTORYA,PAUL GEERLİNGS,SHUBİN LİU,PAUL W AYERS,PROFT FRANK DE
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Theoretical investigation of thione-thiol tautomerism, intermolecular double proton transfer reaction and hydrogen bonding interactions in 4-ethyl-5-(2-hydroxyphenyl)-2H-1,2,4-triazole-3(4H)-thione
COMPUTATIONAL AND THEORETICAL CHEMISTRY, Vol. 1025, No. null, Aralık 2013, s. 35-45, ISSN: 2210-271X
ÖZDEMİR NAMIK,TÜRKPENÇE DENİZ
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A DFT study on electronic and optical properties of BTI-based oligomers
International Symposium on Chemistry Via Computation, istanbul/TÜRKİYE, 30 Ekim 2017
ALİM ÇİSİL,SÜTAY BERKAY,ONARAN GÜLŞAH,YURTSEVER MİNE
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Structures and reactivity of gaseous glycine and its derivatives
International Journal of Mass Spectrometry, Vol. 201, No. 1-3, Temmuz 2000, s. 69-85, ISSN: 13873806
BALTA BÜLENT, BASMA MARAL, AVİYENTE VİKTORYA, ZHU CHUANBAO, LİFSHİTZB CHAVA
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DFT CALCULATIONS ON CONVENTIONAL BINUCLEAR CuAAC REACTION MECHANISM AND RECENT EXPERIMENTS
ESPA 2016 10th Congress on Electronic Structure: Principles and Applications, Castellón/İSPANYA, 28 Haziran 2016
ÖZKILIÇ YILMAZ,TÜZÜN NURCAN
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Colorimetric and fluorimetric sensing of trace amount of Hg2+ in real samples by a new rhodamine B-based Schiff base probe: Smartphone, living cell applications and DFT calculation
Journal of Molecular Structure, Vol. 1321, Şubat 2025, ISSN: 0022-2860
EJDER NEBAHAT,KARAOĞLU KAAN,LEVENT ZEYNEP,ALÇAY YUSUF,ÖZDEMİR EMRE,YAVUZ ÖZGÜR,KAYA KEREM,KOPAR MERVE,TÜZÜN NURCAN,YILMAZ İSMAİL
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Synthesis of a Novel and More Sustainable Cationic Bleach Activator,N-[4-(N,N,N)-Triethylammoniumchloride-butanoyl] Butyrolactam, for Cotton: Optimization and Theoretical Limitations
ACS SUSTAINABLE CHEMISTRY & ENGINEERING, Vol. 10, No. 14, Mart 2022, ISSN: 2168-0485
YILDIRIM EROL,ALTAY PELİN,GÜRSOY NEVİN ÇİĞDEM,J. HAUSER PETER,EL-SHAFEİ AHMED
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Challenging the frontiers of superparamagnetism through strain engineering: DFT investigation and co-precipitation synthesis of large aggregated Fe3O4 (magnetite) powder
Elsevier BV, Vol. 968, Aralık 2023, ISSN: 0925-8388
SARAÇOĞLU MERT, MANSOOR MUBASHİR, BAKIRDÖVEN UTKU, ARPALI HANDENUR, GEZİCİ UTKU ORÇUN, TİMUR SERVET İBRAHİM
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Experimental and DFT Study on Electronic and Optical Properties of Donor-Acceptor Type Copolymers Containing Thiophene (T), Thienothiophene (TT), Dithienothiophene (DTT) and Bithiazole (NBT) Units
” İstanbul International Organic Electronic Symposium, 2 Aralık 2019
SÜTAY BERKAY,YURTSEVER MİNE,CİCİGÜL HAKAN,TİFTİKÇİ ESRA,TOPAL SEBAHAT,ÖZTÜRK TURAN,SEZER ESMA,USTAMEHMETOĞLU BELKIZ
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A novel 3-((5-methylpyridin-2-yl)amino)isobenzofuran-1(3H)-one: Molecular structure describe, X-ray diffractions and DFT calculations, antioxidant activity, DNA binding and molecular docking studies
JOURNAL OF MOLECULAR STRUCTURE, 2020, ISSN: 0022-2860
YILMAZ ZT,ODABAŞOĞLU YASİN,ŞENEL PELİN,ADIMCILAR VESELİNA,GÖLCÜ AYŞEGÜL,ÖZDEMİR AYŞE,ODABAŞOĞLU MUSTAFA,ERDOĞAN TANER
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A DFT study: ranking of antioxidant activity of various candidate molecules
UNEC Journal of Engineering and Applied Sciences, Vol. 1, No. 2, Mayıs 2022, s. 33-40, ISSN: 2790-2358
ENİSOĞLU ATALAY VİLDAN, ATİŞ İREM SUDE, ŞAHİN KORKUT FURKAN, KAŞIKÇI EMEL, KARAHAN MESUT
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Global geometry optimization of small silicon clusters with empirical potentials and at the DFT level
Phys. Chem. Chem. Phys., Vol. 6, Ocak 2004, s. 503
TEKİN ADEM,BERND HARTKE
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Regioselectivity Patterns in Radical Cyclization of Diosphenol Derivatives with Different Ring Size: A Combined Experimental and DFT Study
ChemistrySelect, Vol. 6, Ocak 2021, ISSN: 2365-6549
BOZ ESRA, ÖZCAN HAFİZE, ZAİM ÖMER, TÜZÜN NURCAN
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