Dr. Öğr. Üyesi FAHRİ ALKAN

Yayın Ağı

SCI, SSCI ve AHCI İndekslerine Giren Dergilerde Yayınlanan Makaleler

Theoretical investigation of steric effects on the S1 potential energy surface of o-carborane-anthracene derivatives

Alkan F.

Turkish Journal of Chemistry , cilt.47, sa.3, ss.646-655, 2023 (SCI-Expanded)

An Ultrastable 155-Nuclei Silver Nanocluster Protected by Thiacalix[4]arene and Cyclohexanethiol for Photothermal Conversion

Wang Z., ALKAN F., Aikens C. M., Kurmoo M., Zhang Z., Song K., et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION , cilt.61, sa.31, 2022 (SCI-Expanded)

Revisiting the Role of Charge Transfer in the Emission Properties of Carborane-Fluorophore Systems: A TDDFT Investigation

TAHAOĞLU D., USTA H., ALKAN F.

JOURNAL OF PHYSICAL CHEMISTRY A , cilt.126, sa.26, ss.4199-4210, 2022 (SCI-Expanded)

Theoretical investigation of substituent effects on the relative stabilities and electronic structure of [BnXn](2-) clusters

TAHAOĞLU D., ALKAN F., DURANDURDU M.

JOURNAL OF MOLECULAR MODELING , cilt.27, sa.12, 2021 (SCI-Expanded)

Understanding and Tailoring Excited State Properties in Solution-Processable Oligo(p-phenyleneethynylene)s: Highly Fluorescent Hybridized Local and Charge Transfer Character via Experiment and Theory

USTA H., ÇOŞUT B., ALKAN F.

JOURNAL OF PHYSICAL CHEMISTRY B , cilt.125, sa.42, ss.11717-11731, 2021 (SCI-Expanded)

Understanding the Effect of Symmetry Breaking on Plasmon Coupling from TDDFT

ALKAN F., Aikens C. M.

JOURNAL OF PHYSICAL CHEMISTRY C , cilt.125, sa.22, ss.12198-12206, 2021 (SCI-Expanded)

TD-DFTB study of optical properties of silver nanoparticle homodimers and heterodimers

Liu Z., Alkan F., Aikens C. M.

JOURNAL OF CHEMICAL PHYSICS , cilt.153, sa.14, 2020 (SCI-Expanded)

A hybridized local and charge transfer excited state for solution-processed non-doped green electroluminescence based on oligo(p-phenyleneethynylene)

USTA H., Alimli D., ÖZDEMİR R., Tekin E., ALKAN F., Kacar R., et al.

JOURNAL OF MATERIALS CHEMISTRY C , cilt.8, sa.24, ss.8047-8060, 2020 (SCI-Expanded)

Understanding plasmon coupling in nanoparticle dimers using molecular orbitals and configuration interaction

ALKAN F., Aikens C. M.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS , cilt.21, sa.41, ss.23065-23075, 2019 (SCI-Expanded)

Highly Efficient Deep-Blue Electroluminescence Based on a Solution-Processable A-pi-D-pi-A Oligo(p-phenyleneethynylene) Small Molecule

USTA H., Alimli D., ÖZDEMİR R., Dabak S., Zorlu Y., ALKAN F., et al.

ACS APPLIED MATERIALS & INTERFACES , cilt.11, sa.47, ss.44474-44486, 2019 (SCI-Expanded)

Understanding the Effect of Doping on Energetics and Electronic Structure for Au-25, Ag-25, and Au-38 Clusters

Alkan F., Pandeya P., Aikens C. M.

JOURNAL OF PHYSICAL CHEMISTRY C , cilt.123, sa.14, ss.9516-9527, 2019 (SCI-Expanded)

[Ag-48(C (CBu)-Bu-t)(20)(CrO4)(7)]: An Atomically Precise Silver Nanocluster Co-protected by Inorganic and Organic Ligands

Zhang S., Alkan F., Su H., Aikens C. M., Tung C., Sun D.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY , cilt.141, sa.10, ss.4460-4467, 2019 (SCI-Expanded)

Different Silver Nanoparticles in One Crystal: Ag-210((PrPhS)-Pr-i)(71)(Ph3P)(5)Cl and Ag-211((PrPhS)-Pr-i)(71)(Ph3P)(6)Cl

Liu J., Alkan F., Wang Z., Zhang Z., Kurmoo M., Yan Z., et al.

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION , cilt.58, sa.1, ss.195-199, 2019 (SCI-Expanded)

Spin-orbit effects on the Te-125 magnetic-shielding tensor: A cluster-based ZORA/DFT investigation

Alkan F., Dybowski C.

SOLID STATE NUCLEAR MAGNETIC RESONANCE , cilt.95, ss.6-11, 2018 (SCI-Expanded)

TD-DFT and TD-DFTB Investigation of the Optical Properties and Electronic Structure of Silver Nanorods and Nanorod Dimers

Alkan F., Aikens C. M.

JOURNAL OF PHYSICAL CHEMISTRY C , cilt.122, sa.41, ss.23639-23650, 2018 (SCI-Expanded)

Relativistic DFT investigation of electronic structure effects arising from doping the Au-25 nanocluster with transition metals

Alkan F., Munoz-Castro A., Aikens C. M.

NANOSCALE , cilt.9, sa.41, ss.15825-15834, 2017 (SCI-Expanded)

Role of Exact Exchange and Relativistic Approximations in Calculating F-19 Magnetic Shielding in Solids Using a Cluster Ansatz

Alkan F., Holmes S. T., Dybowski C.

JOURNAL OF CHEMICAL THEORY AND COMPUTATION , cilt.13, sa.10, ss.4741-4752, 2017 (SCI-Expanded)

Analysis of the Bond-Valence Method for Calculating Si-29 and P-31 Magnetic Shielding in Covalent Network Solids

Holmes S. T., Alkan F., Iuliucci R. J., Mueller K. T., Dybowski C.

JOURNAL OF COMPUTATIONAL CHEMISTRY , cilt.37, sa.18, ss.1704-1710, 2016 (SCI-Expanded)

Spin-orbit effects on the Sn-119 magnetic-shielding tensor in solids: a ZORA/DFT investigation

Alkan F., Holmes S. T., Iuliucci R. J., Mueller K. T., Dybowski C.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS , cilt.18, sa.28, ss.18914-18922, 2016 (SCI-Expanded)

Ion pairing in H2O and D2O solutions of lead nitrate, as determined with Pb-207 NMR spectroscopy

Alkan F., Small T., Bai S., Dominowski A., Dybowski C.

JOURNAL OF STRUCTURAL CHEMISTRY , cilt.57, sa.2, ss.369-375, 2016 (SCI-Expanded)

Effect of Co-Ordination Chemistry and Oxidation State on the Pb-207 Magnetic-Shielding Tensor: A DFT/ZORA Investigation

Alkan F., Dybowski C.

JOURNAL OF PHYSICAL CHEMISTRY A , cilt.120, sa.1, ss.161-168, 2016 (SCI-Expanded)

Chemical-shift tensors of heavy nuclei in network solids: a DFT/ZORA investigation of Pb-207 chemical-shift tensors using the bond-valence method

Alkan F., Dybowski C.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS , cilt.17, sa.38, ss.25014-25026, 2015 (SCI-Expanded)

Pb-207 and Sn-119 Solid-State NMR and Relativistic Density Functional Theory Studies of the Historic Pigment Lead-Tin Yellow Type I and Its Reactivity in Oil Paintings

Catalano J., Murphy A., Yao Y., Alkan F., Zurnbulyadis N., Centeno S. A., et al.

JOURNAL OF PHYSICAL CHEMISTRY A , cilt.118, sa.36, ss.7952-7958, 2014 (SCI-Expanded)

Calculation of chemical-shift tensors of heavy nuclei: a DFT/ZORA investigation of Hg-199 chemical-shift tensors in solids, and the effects of cluster size and electronic-state approximations

Alkan F., Dybowski C.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS , cilt.16, sa.27, ss.14298-14308, 2014 (SCI-Expanded)

A Combined NMR and DFT Study of Narrow Gap Semiconductors: The Case of PbTe

Taylor R. E., Alkan F., Koumoulis D., Lake M. P., King D., Dybowski C., et al.

JOURNAL OF PHYSICAL CHEMISTRY C , cilt.117, sa.17, ss.8959-8967, 2013 (SCI-Expanded)

Theoretical investigation of excited states of oligothiophene anions

Alkan F., Salzner U.

JOURNAL OF PHYSICAL CHEMISTRY A , cilt.112, sa.27, ss.6053-6058, 2008 (SCI-Expanded)

Diğer Dergilerde Yayınlanan Makaleler

External complexation of BODIPYs by CB[7] improves in-cell fluorescence imaging

Ayhan M. M., Ozcan E., ALKAN F., Cetin M., Un I., Bardelang D., et al.

MATERIALS ADVANCES , cilt.3, ss.547-553, 2022 (ESCI)

Hakemli Bilimsel Toplantılarda Yayımlanmış Bildiriler

Theoretical investigation of the electronic structure and stability for doped Au25 clusters

Alkan F., Munoz Castro A., Aikens C.

255th National Meeting and Exposition of the American-Chemical-Society (ACS) - Nexus of Food, Energy, and Water, Louisiana, Amerika Birleşik Devletleri, 18 - 22 Mart 2018, cilt.255

TD-DFTB investigation of electronic structure and optical properties of silver nanorods and nanorod dimers

Alkan F., Aikens C.

255th National Meeting and Exposition of the American-Chemical-Society (ACS) - Nexus of Food, Energy, and Water, Louisiana, Amerika Birleşik Devletleri, 18 - 22 Mart 2018, cilt.255

Metrikler

Dr. Öğr. Üyesi FAHRİ ALKAN

Yayınlar & Eserler

Theoretical investigation of steric effects on the S1 potential energy surface of o-carborane-anthracene derivatives

An Ultrastable 155-Nuclei Silver Nanocluster Protected by Thiacalix[4]arene and Cyclohexanethiol for Photothermal Conversion

Revisiting the Role of Charge Transfer in the Emission Properties of Carborane-Fluorophore Systems: A TDDFT Investigation

Theoretical investigation of substituent effects on the relative stabilities and electronic structure of [BnXn](2-) clusters

Understanding and Tailoring Excited State Properties in Solution-Processable Oligo(p-phenyleneethynylene)s: Highly Fluorescent Hybridized Local and Charge Transfer Character via Experiment and Theory

Understanding the Effect of Symmetry Breaking on Plasmon Coupling from TDDFT

TD-DFTB study of optical properties of silver nanoparticle homodimers and heterodimers

A hybridized local and charge transfer excited state for solution-processed non-doped green electroluminescence based on oligo(p-phenyleneethynylene)

Understanding plasmon coupling in nanoparticle dimers using molecular orbitals and configuration interaction

Highly Efficient Deep-Blue Electroluminescence Based on a Solution-Processable A-pi-D-pi-A Oligo(p-phenyleneethynylene) Small Molecule

Understanding the Effect of Doping on Energetics and Electronic Structure for Au-25, Ag-25, and Au-38 Clusters

[Ag-48(C (CBu)-Bu-t)(20)(CrO4)(7)]: An Atomically Precise Silver Nanocluster Co-protected by Inorganic and Organic Ligands

Different Silver Nanoparticles in One Crystal: Ag-210((PrPhS)-Pr-i)(71)(Ph3P)(5)Cl and Ag-211((PrPhS)-Pr-i)(71)(Ph3P)(6)Cl

Spin-orbit effects on the Te-125 magnetic-shielding tensor: A cluster-based ZORA/DFT investigation

TD-DFT and TD-DFTB Investigation of the Optical Properties and Electronic Structure of Silver Nanorods and Nanorod Dimers

Relativistic DFT investigation of electronic structure effects arising from doping the Au-25 nanocluster with transition metals

Role of Exact Exchange and Relativistic Approximations in Calculating F-19 Magnetic Shielding in Solids Using a Cluster Ansatz

Analysis of the Bond-Valence Method for Calculating Si-29 and P-31 Magnetic Shielding in Covalent Network Solids

Spin-orbit effects on the Sn-119 magnetic-shielding tensor in solids: a ZORA/DFT investigation

Ion pairing in H2O and D2O solutions of lead nitrate, as determined with Pb-207 NMR spectroscopy

Effect of Co-Ordination Chemistry and Oxidation State on the Pb-207 Magnetic-Shielding Tensor: A DFT/ZORA Investigation

Chemical-shift tensors of heavy nuclei in network solids: a DFT/ZORA investigation of Pb-207 chemical-shift tensors using the bond-valence method

Pb-207 and Sn-119 Solid-State NMR and Relativistic Density Functional Theory Studies of the Historic Pigment Lead-Tin Yellow Type I and Its Reactivity in Oil Paintings

Calculation of chemical-shift tensors of heavy nuclei: a DFT/ZORA investigation of Hg-199 chemical-shift tensors in solids, and the effects of cluster size and electronic-state approximations

A Combined NMR and DFT Study of Narrow Gap Semiconductors: The Case of PbTe

Theoretical investigation of excited states of oligothiophene anions

External complexation of BODIPYs by CB[7] improves in-cell fluorescence imaging

Theoretical investigation of the electronic structure and stability for doped Au25 clusters

TD-DFTB investigation of electronic structure and optical properties of silver nanorods and nanorod dimers

Yayın

Atıf (WoS)

H-İndeks (WoS)

Atıf (Scopus)

H-İndeks (Scopus)