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Academic Journal

2-Formilpiridin N(4)-Metil Tiyosemikarbazon Ve 2-Asetilpiridin N(4)-Etil Tiyosemikarbazon Moleküllerinin Teorik Olarak İncelenmesi

Subjects: 2-formilpiridin n(4)-metil tiyosemikarbazon; 2-asetilpiridin n(4)-etil tiyosemikarbazon; dft

  • Source: Düzce Üniversitesi Bilim ve Teknoloji Dergisi, Vol 11, Iss 4, Pp 1747-1757 (2023)

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Academic Journal

Synthesis and Analysis of Some Azo Dyes Obtained from Benzothiazole by Density Functional Theory

Subjects: benzotiyazol; dft.; heterocyclic

  • Source: Süleyman Demirel Üniversitesi Fen-Edebiyat Fakültesi Fen Dergisi, Vol 18, Iss 2, Pp 181-194 (2023)

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Academic Journal

Strain Dependent Electronic Properties of Hexagonal Monolayer Boron Phosphide with GPAW using GLLB-SC and PBE

Subjects: dft; hexagonal boron phosphide; 2d materials

  • Source: Gazi Üniversitesi Fen Bilimleri Dergisi, Vol 11, Iss 3, Pp 643-651 (2023)

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Academic Journal

Bromukonazol’ ün Moleküler Etkileşim Mekanizmasının DFT ve Moleküler Kenetleme Yöntemleri İle Açıklanması

Subjects: dft; moleküler kenetlenme; bromukanazol

  • Source: Süleyman Demirel Üniversitesi Fen Bilimleri Enstitüsü Dergisi, Vol 27, Iss 2, Pp 266-272 (2023)

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Academic Journal

A Heterocyclic Compound Hispidulin: Theoretical Investigation by DFT/TD-DFT Methods and Molecular Docking Studies

Subjects: hispidulin; dft; td-dft

  • Source: Süleyman Demirel Üniversitesi Fen Bilimleri Enstitüsü Dergisi, Vol 26, Iss 3, Pp 515-522 (2022)

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Academic Journal

REEL SİNÜSLERDE AYRIK FOURIER DÖNÜŞÜMÜNÜN ÜÇ ÖRNEĞİNE DAYALI FREKANS KESTİRİMİ

Subjects: frekans kestirimi; ayrık fourier dönüşümü; sinc fonksiyonu

  • Source: Uludağ University Journal of The Faculty of Engineering, Vol 27, Iss 3, Pp 911-926 (2022)

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Academic Journal

Triafulvalen, Pentafulvalen ve Heptafulvalenin Katyon ve Anyon Radikallerinin EPR Aşırı İnce-yapı Yapıları: Bir Teorik Çalışma

Subjects: fulvalene; i̇nceyapı yarılması; epr

  • Source: Süleyman Demirel Üniversitesi Fen-Edebiyat Fakültesi Fen Dergisi, Vol 17, Iss 1, Pp 138-145 (2022)

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Academic Journal

Abietan İskeletine Sahip Szemaoenoid A Molekülünün Teorik Olarak İncelenmesi

Subjects: abietan; yft; hf

  • Source: Süleyman Demirel Üniversitesi Fen-Edebiyat Fakültesi Fen Dergisi, Vol 17, Iss 1, Pp 82-95 (2022)

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Academic Journal

Investigation of Expired Depakin Tablet as Corrosion Inhibitor for Decreasing Carbon Footprint ; Karbon Ayak İzinin Azaltılması için Korozyon İnhibitörü Olarak Son Kullanma Tarihi Geçmiş Depakin Tabletin İncelenmesi

Subjects: DFT; EIS; Pharmacological chemicals

  • Source: Kadirli Uygulamalı Bilimler Fakültesi Dergisi; Vol. 3 No. 1 (2023): Journal of Kadirli Faculty of Applied Sciences; 56-66 ; Kadirli Uygulamalı Bilimler Fakültesi Dergisi; Cilt 3 Sayı 1 (2023):

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Academic Journal

2-((2-Hidroksibenziliden)amino)-4-Nitrofenol Schiff Bazının Teorik Olarak İncelenmesi ve Bazı Quantum Kimyasal Parametrelerinin Hesaplanması

Subjects: konformasyon analizi; schiff bazı; tautomerizm

  • Source: Süleyman Demirel Üniversitesi Fen Bilimleri Enstitüsü Dergisi, Vol 25, Iss 3, Pp 685-698 (2021)

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  • 1-10 of  234 results for ""DFT""