Publications

The scientific publications of our research center

Toplam: 57 yayın
Tarih Makale Başlığı Yazarlar Dergi Erişim
05.09.2026 Structural, optical, and dielectric studies on transition metals doping (Cu, Ni) in MgFe2O4 ferrites Dhahri, Siwar Dhahri; Omri, Aref Omri; Dhaou, Mohamed Houcine; Dhahri, Essebti; Graça, Manuel P.F.; Brito, Anna B.; Fausto, Rui; Pina, João; Costa, Benilde F.O. Ceramics International (2025).
01.08.2026 Enhancement of surface adhesion between Poly(L-lactic Acid) and medical-grade 316L stainless steel Ivanov M., Rocha J., Nikitin T., Fausto R., Vilarinho P. M. Surfaces and Interfaces
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08.06.2026 Synthesis, Structure, Vibrational Spectra and Thermal Analysis of Isoniazid-Succinic Acid Cocrystal İnan N. İ., Syeıtkhajy A., Yılmaz A., Sarıer N., Öğrüç Ildız G., Fausto R. Photochemistry and Spectroscopy
14.05.2026 Characterizing Gateway Modes for Solid–Solid Phase Transitions in Organic Crystals: The Thermosalient 4-DBpFO Daria Ruth Galimberti, Xinyue Li, Maarten W. de Dreu, Timur Nikitin, Kingshuk Mukhuti, Jialiang Xu, Rui Fausto, Peter C.M. Christianen, . Theo Rasing, and Herma Cuppen Journal of the American Chemical Society
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05.05.2026 Spectroscopic and DFT-based characterization of V(V)–alizarin red S complexes: Structural, optical, and photonic insights Yadigar Gülseven Sıdır,a b; Licínia L.G. Justino,b; M. Luísa Ramos, b; Cecília Madeira, b; Telma Costa, b; Rui Fausto, b c; Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy (Elsevier)
17.04.2026 NIR excitation-driven conformational isomerizations of thymol and carvacrol isolated in a nitrogen cryomatrix Leonardo J. Duarte, Cláudio M. Nunes, Ataualpa A. C. Braga, Rui Fausto & A. J. Lopes Jesus Physical Chemistry Chemical Physics
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08.04.2026 Computational and Spectroscopic Insights Into the Rice Bran Derived Glu‐Gln‐Arg‐Pro‐Arg Pentapeptide as an Anticancer Agent: A DFT, Molecular Docking, and Molecular Dynamics Study Gozde Yilmaz, Sefa Celik, Aysen E. Ozel, Sevim Akyuz International Journal of Quantum Chemistry
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02.04.2026 Picolinamide-Saccharin Cocrystal: Synthesis, Structure, Vibrational Spectra and Thermal Behavior Syeitkhajy, Ainur; Yilmaz, Ayberk; Sarıer, Nihal; Ogruc Ildiz, Gulce; Fausto, Rui Journal of Molecular Structure
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01.04.2026 Physical and chemical characterisation of ophthalmic lens-grinding wastewater: uncovering environmental implications Juliana Araújo, Pedro Ramos, Elsa Silvestre, Artur Mateus, Anabela Massano, Timur Nikitin, Rui Fausto, Pedro S. P. Silva, António J. Guiomar, Pedro F. Cruz, Abílio J. F. N. Sobral & Telma Encarnação Environmental Science and Pollution Research
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28.03.2026 Synthesis, Structure, Vibrational Spectra and Thermal Analysis of Isoniazid-Succinic Acid Cocrystal Inan, Neris İnci; Syeitkhajy, Ainur; Yilmaz, Ayberk; Sarier, Nihal; Ogruc Ildiz, Gulce; Fausto, Rui Photochemistry and Spectroscopy
16.03.2026 Triplet 4-Nitrenemethyl-Pyridine-N-Oxide: A Model Alkyl Nitrene Isolated in Cryogenic Matrices Cláudio M. Nunes, A. J. Lopes Jesus, Tatiana Caneca, Gemma Aragay, Pablo Ballester & Rui Fausto Journal of Physical Organic Chemistry
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16.03.2026 Comprehensive analysis of zinc-based organic-inorganic hybrid material: Structural, optical, ionic conductivity and DFT study of (C₆H₉N₂)₂ZnCl₄ Arafet Ghoudi, Najoua Weslati, Noweir Ahmad Alghamdi, Benilde F. O. Costa, Rui Fausto, Houcine Ghalla & Abderrazek Oueslati Ionics
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12.03.2026 Vibrational Spectroscopy and Biospectroscopy: Celebrating the Scientific Legacy of Professor Henry H. Mantsch Sylvia Turrell & Rui Fausto Spectroscopy Journal (Spectrosc. J.)
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07.03.2026 Mapping binding sites of human serum albumin and its nanoparticles: I. Hydrophobicity profile of binding sites Aytaj J Mammadova Guliyeva, Matanat J Bakhishova, Oktay K Gasymov, Sefa Celik, Sevim Akyuz, Aysen E Ozel Journal of Biomolecular Structure and Dynamics
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20.02.2026 Experimental and computational insights of the new hybrid organic–inorganic compound (C6H9N2)2CdI4 for advanced optoelectronic applications and biological activities Arafet Ghoudi, Rui Fausto aWalid Taouali,b Jose ´ A. Paixa ˜o, efand Abderrazek Oueslati *a Royal Society of Chemistry
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12.02.2026 Enhanced Magnetic and Optical Properties of La₀.₅₇Nd₀.₁Sr₀.₁₈Ag₀.₁₅CoO₃ Cobaltite: A Theoretical Study for Optoelectronic Applications F. Issaoui, M. Jeddi, H. Issaoui, T. Ben Slimen, J. Othmani, E. Dhahri, K. Khirouni, Benilde F.O. Costa, Bernardo A. Nogueira & Rui Fausto Journal of Superconductivity and Novel Magnetism
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05.02.2026 Unveiling of the structural, optical and dielectric proprieties of cobaltite compound La0.57Nd0.1Sr0.18Ag0.15CoO3for optoelectronic application. Benslimen, T.; M. Brahmi; Costa, Benilde F.O; Nogueira, Bernardo A.; Fausto, Rui. Journal of Molecular Structure (2025), 144283.
20.01.2026 Detailed insight into the structure and bioactivity of thymocartin, as a potential anticancer and antibacterial agent, through conformational and vibrational analysis, molecular docking, and molecular dynamics studies Alev Er Sefa Celik Aysen E. Ozel Sevim Akyuz Bulletin of the Chemical Society of Ethiopia
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16.01.2026 Conformational Features, Electronic Structure, and Molecular Docking Studies of H-Trp-Arg-OH and H-Trp-Glu-OH Dipeptides Gulshen A. Agaeva, Sefa Celik, Sevim Akyuz, Ulker T. Agaeva, Niftali M. Godjaev & Aysen E. Ozel Russian Journal of Physical Chemistry A
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03.01.2026 Comprehensive analysis of a novel iron(III) bromide based organic-inorganic hybrid material: Structural, conduction mechanisms and magnetic properties studies Khelifi, I.; Ben Brahim, K.; Garoui, I.; Paixão, J. A.; Alghamdi, N. A.; Rekik, W.; Fausto, R.; Oueslati, A. Published by Elsevier, 12 February 2026
29.12.2025 Launching a New Forum for Light–Matter Science: On the Inaugural Issue of Photochemistry and Spectroscopy Rui Fausto Photochemistry and Spectroscopy
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19.12.2025 Upcycling of Electric Arc Furnace Slag for Phosphate Removal: A Green Solution for Water Treatment Giulia Bragaggia; Francesco Rosato; Timur Nikitin; Rui Fausto2,3; Mirko Prato; Alessandra Primavera; Giuseppe Giacomini; Lidia Soldà; Andrea Tapparo; Annalisa Sandon; Maria Cristina Lavagnolo; Silvia Gross. Chemistry Europe
28.11.2025 A water-soluble Schiff base ligand and its Al(III) complex: optical properties, computational studies and photocatalytic performance Bouznif, Hajer; Justino, Licínia LG; Costa, Telma; Soares, Maria IL; Ramos, M. Luísa; Pinho e Melo, Teresa MVD; Zouari, Nabil; and Fausto, Rui. Inorganica Chimica Acta (2025)
04.09.2025 Photochemistry of 2-aminooxazole: a matrix-isolation and computational study of a putative key prebiotic molecule Nunes, Cláudio M.; Viegas, Luís P.; Tripathi, Anuj; Braz, Sofia; Fausto, Rui Physical Chemistry Chemical Physics (2025).
01.09.2025 Structural, Docking, Molecular Dynamics and Antibacterial Analysis of Thymopentin: A Potent Anti-Cancer, -COVID-19 And Viral Er, Alev Çelik, Sefa Çakır, Elif Özel, Ayşen E. AKYÜZ, SEVİM Chemical Society of Ethiopia
01.09.2025 An investigation on the vibrational analysis, molecular structure and interaction with the cellulase enzymes of the cellulose I alpha and cellulose I beta: DFT calculations, docking simulations Aliye Demet Demirag Sefa Celik Aysen E. Ozel Sevim Akyuz Bulletin of the Chemical Society of Ethiopia
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25.08.2025 The Significance of Doxylamine, an Antihistamine Compound, in the Context of Its Potential Efficacy against COVID-19: Conformational Analysis, Molecular Docking, and Molecular Dynamics Studies Alev Er; Onem, Zeynep C.; Celik, Sefa; Ozel, Aysen E.; Akyuz, Sevim Russian Journal of Physical Chemistry A
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21.08.2025 Molecular Structure, Matrix-Isolation IR Spectrum and UV-Induced Transformations of 2-Amino-5-(4-Methoxyphenyl)-1,3,4-Oxadiazole Sıdır, Isa; Lopes, Susy; Fausto, Rui; Jesus, Antonio. J. L. Molecules (2025), 30, 3444.
05.08.2025 Structural and Vibrational Characterizations of Alizarin Red S Catalán, César A. N.; Licínia L. G. Justino; Rui Fausto; Gulce O. Ildiz; Silvia Antonia Brandán Molecules (2025), 30, 3286.
17.07.2025 Vibrational spectroscopic, thermophysical, and structural properties of two Antarctic howardites: EET 87503 and QUE 97001 Unsalan, Ozan; Altunayar-Unsalan, Cisem; Nogueira, Bernardo A.; Kaliwoda, Melanie.; Fausto, Rui Advances in Space Research (2025).
17.07.2025 Single-Crystal Polarized Raman Spectra of 6-Bromopyridine-2-carbaldehyde Brito, Anna Luiza B.; Nogueira Bernardo A.; Ogruc Ildiz, Gülce; Tommasini, Matteo; Fausto, Rui Journal of Raman Spectroscopy (2025): 1–15.
15.07.2025 Hydrogen Tunneling in Thiobenzamide: A Case Study on Tunneling Through High-Energy Barriers Roque, José P.; Nunes, Cláudio M.; Ntungwe, Epole; Fernández-Ramos, Antonio; Fausto, Rui The Journal of Organic Chemistry (2025).
01.07.2025 Co-doped FeNbO4: Simple synthesis, DFT calculations and electrochemical performance for the hydrogen evolution reaction in alkaline medium Juca, Ralf R.; Evaristo, Diego S.; Oliveira, Francisco S. G.; Santos, Luís R. M.; Salviano, Gilberto D.; De Castro, Antônio J. R.; Ferreira, Milson S.; Lothar, Luís F.; Soares, João M. Brito; Anna Luiza B.; Fausto, Rui; Macêdo, Marcelo A.; Costa, Benilde F. C. Journal of Physics and Chemistry of Solids, 202 (2025) 112649.
25.06.2025 Matrix isolation of vapors from 1,2,4-triazolium salts: Exploring the generation of N-heterocyclic carbenes Caneca, Tatiana; Ntungwe, Epole; Duarte,Leonardo J.; Jesus, Lopes A.; Nunes, Cláudio M.; Fausto, Rui Journal of Molecular Structure, (2025) 143058.
15.06.2025 Solid Liquid Phase Diagram of the Dimethyl+Dipropyl Adipates System: Application to Low Temperature Thermal Energy Storage Sequeira, Maria C. M.; Nikitin, Timur; Caetano, Fernando J. P.; Diogo, Hermínio P.; Fareleira, João M. A. N.; Fausto, Rui International Journal of Thermophysics, 46, 131 (2025)
05.06.2025 Molecular Docking and Molecular Dynamics Analyses of Pazopanib with VEGF Receptors Alev Er Zeynep Çiçek Önem Sefa Çelik Ayşen Özel Sevim Akyüz European Journal of Biology
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31.05.2025 Computational Insights Into the Mechanism of Action of Bleomycin as Anticancer and Antibacterial Agent-Via Molecular Docking and Molecular Dynamics ER A., ÇELİK S., ÖZEL A., AKYÜZ S. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
15.05.2025 Analysis of Plant-based Commercial Milk Substitutes Using ATR-FTIR Spectroscopy Brito, Anna Luiza B.; Duarte, Catarina; Fausto, Rui Journal of Food Composition and Analysis (2025) 107786.
01.05.2025 A comprehensive exploration of optical properties of GdAlO3:Cr3+ Soussi; Hajer; Kammoun, S.; Dhaif, E.; Pina, João; Costa, Benilde F. C.; Fausto, Rui Optical Materials, 162 (2025) 116841.
07.03.2025 Phase Equilibrium of n-Nonane + n-Decane for Low-Temperature Thermal Energy Storage: Insights into Odd–Even Effects Sequeira, Maria C. M.; Nikitin, Timur; Caetano, Fernando J. P.; Diogo, Hermínio P.; Faleiro, João M. A. N.; Fausto, Rui International Journal of Thermophysics, 46.4 (2025) 1-19.
25.02.2025 Infrared Spectrum and UV-Triggered Transformations of Matrix-isolated Meta-Fluorohydroquinol Supported by Ground and Excited State Theoretical Calculations Lopes Jesus, António J.; Lucena, Juracy R. Jr.; Rodrigues, G. P.; Ogruc Ildiz, Gülce; de Monte; Silmara A.; Ventura, Eliezer; Fausto, Rui Journal of Computational Chemistry, 46.6 (2025) e70045.
06.02.2025 Reversal in Solvatochromism, enol-imine/keto-amine Tautomerism and (E)-(Z) Photoisomerizations in a Benzyidene Aniline Schiff Base Derivative in Different Solvents Sidir, Isa; Gülveren Sidir; Yadigar; Berber, Halil; Ramos, Maria Luísa; Justino, Licínia L. G.; Fausto, Rui Molecules, 30.3 (2025) 745.
23.01.2025 Solvatochromism and cis-trans isomerism in azobenzene-4-sulfonyl chloride Sidir, Isa; Gülveren Sidir; Yadigar; Berber, Halil; Fausto, Rui Photochemical & Photobiological Sciences, 24 (2025) 1-15.
22.01.2025 A protocol for the investigation of the intramolecular vibrational energy redistribution problem: the isomerization of nitrous acid as a case of study Duarte, Leonardo J.; Nunes, Cláudio M.; Fausto, Rui; Braga, Ataualpa A.C. Physical Chemistry Chemical Physics,PCCP 27.7 (2025) 3685-3700
05.01.2025 Novel tetradentate N2O2 water-soluble Schiff Base and its Al(III) complex: Synthesis, structural characterization, and correlations between structure and stability against hydrolysis Bouznif, Hajer; Justino, Licínia L. G.; Soares, Maria I. L.; Costa, Telma; Ramos, Maria Luísa; Nikitin, Timur; Pinho e Melo, Teresa M. V. D.; Zouari, Nabi; Fausto, Rui Journal of Molecular Structure, 1331 (2025) 141581.
01.01.2025 Structure, IR spectrum and UV-induced photochemistry of a pyridyl-substituted 1, 3, 4-oxadiazole-thione in Ar matrix and intermolecular interactions in the neat crystalline phase Sıdır, Isa; Lopes, Susy; Paixão, José A.; Nikitin, Timur; Jesus, Antonio. J. L.; Fausto, Rui Journal of Photochemistry and Photobiology A: Chemistry (2025) 116610
06.12.2024 Efficient synthesis of phosphorus-promoted and alkali-modified ZSM-5 catalyst for catalytic dehydration of lactic acid to acrylic acid Ainur Syeitkhajy, Mohammed Alfatih Hamid, Mehtap Safak Boroglu, Ismail Boz RESULTS IN CHEMISTRY
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09.02.2024 Influence of Metal Ions and Organic Solutions on Activity and Stability of Beta-Glucosidase Nanoflowers Altinkaynak C., Samsa C. G., Ekremoglu M., Türk M., Ozturkler M., Özdemir N., Atakisi O., CHEMISTRYSELECT
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31.01.2024 Thermomechanical behavior of polyurethane nanocomposite foams containing organoclay particles modified with bio-based fatty acid Emel Onder, Nihal Sarier Thermochimica Acta
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30.01.2024 3B Yazıcı ile Üretilen Biyouyumlu AFO'ların Mekanik Analizi Bahadır Bozkurt , M. Hüsnü Dirikolu Journal of Medical Sciences
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02.05.2023 A Novel Biomaterial for Decolorization of Azo Dyes: Myoglobin-Zn(II) Assisted Hybrid Nanoflowers Altinkaynak C., Türk M., Yangin N., Özdemir N. CHEMISTRY & BIODIVERSITY
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15.10.2022 Fabrication of myoglobin hybrid nanoflowers for decolorization process of evans blue and congo red Türk M., Altinkaynak C., Yangin N., Özdemir N. MATERIALS LETTERS
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05.01.2022 Hemoglobin-Inorganic Hybrid Nanoflowers with Different Metal Ions as Potential Oxygen Carrying Systems Gulmez C., Altinkaynak C., Türk M., Özdemir N., Atakisi O. CHEMISTRY & BIODIVERSITY
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31.12.2021 PEROXIDASE-LIKE ACTIVITY OF HEMOGLOBIN-BASED HYBRID MATERIALS AGAINST DIFFERENT SUBSTRATES AND THEIR ENHANCED APPLICATION FOR H<sub>2</sub>O<sub>2</sub> DETECTION Altinkaynak C., Türk M., Ekremoglu M., Özdemir N. BULLETIN OF THE CHEMICAL SOCIETY OF ETHIOPIA
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25.11.2021 Amino acid-metal phosphate hybrid nanoflowers (AaHNFs): their preparation, characterization and anti-oxidant capacities Özdemir N., Altinkaynak C., Türk M., Gecili F., Tavlasoglu S. POLYMER BULLETIN
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29.09.2020 Fluorescent Copper Phosphate Nanoflowers: A Novel Toxicity Investigation Study Based On Tenebrio Molitor Linnaeus, 1758 (Coleoptera: Tenebrionidae) Larvae Eskin A., Altınkaynak C., Durmuş M., Özdemir N. Bitlis Eren Üniversitesi Fen Bilimleri Dergisi
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04.09.2020 Phytocosmetics and Beyond: The Enzyme Inhibitory Activities of Two Rosaceae Plant Extracts and Their Cupper-Nanoflowers Koca Çalışkan U., Dönmez C., Eruygur N., Ayaz F., Altınkaynak C., Durmuş M., Özdemir N. International Journal of Phytocosmetics and Natural Ingredients
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