Ινστιτούτο Θεωρητικής και Φυσικής Χημείας (ΙΘΦΧ) - Επιστημονικό έργο

Περιλαμβάνονται δημοσιεύσεις σε έγκριτα διεθνή επιστημονικά περιοδικά, εργασίες ερευνητών, πρακτικά συνεδρίων, βιβλία, μονογραφίες, διαλέξεις, εκπαιδευτικό υλικό, ενημερωτικά δελτία, πολυμεσικό υλικό (βίντεο) και ερευνητικά αποτελέσματα.
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Collection's Items (Sorted by Τίτλος in Αύξουσα order): 2201 to 2220 of 2616
ΤύποςΗμερομηνίαΤίτλοςΔημιουργόςΠλήρες κείμενο
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2018The activation of carbon dioxide by first row transition metals (Sc-Zn)Blaziak K.; Tzeli, D.; Xantheas S.S.; Uggerud E.
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2024The Complementary Use of Raman, ATR‐FTIR Spectroscopy, and Chemometrics for Investigating the Deterioration of Artificially Aged ParchmentMalea, Ekaterini; Boyatzis, Stamatis C.; Karlis, Dimitris; Palles, Dimitrios; Boghosian, Soghomon; Zervos, Spiros
Open access
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2022The dual role of bismuth in Li2O–Bi2O3–B2O3 glasses along the orthoborate joinTopper, Brian; Tsekrekas, Elizabeth M.; Greiner, Lucas; Youngman, Randall E.; Kamitsos, Efstratios I.; Möncke, Doris
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2025The Effect of A-Cation and X-Anion Substitutions on the Electronic and Structural Properties of A2ZrX6 'Defect' Perovskite Materials: A Theoretical Density Functional Theory StudyKolokytha, Christina; Lathiotakis, Nektarios N. ; Kaltzoglou, Andreas; Petsalakis, Ioannis D.; Tzeli, Demeter
Open access
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2022The Effect of Geometry, Spin, and Orbital Optimization in Achieving Accurate, Correlated Results for Iron-Sulfur CubanesMejuto-Zaera, Carlos; Tzeli, Demeter; Williams-Young, David; Tubman, Norm M; Matoušek, Mikuláš; Brabec, Jiri; Veis, Libor; Xantheas, Sotiris S; De Jong, Wide A.
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2021The Impact of Ionic Liquid Loading in Three-Dimensional Carbon Nanotube Networks on the Separation of CO2/CH4 Fluid Mixtures: Insights from Molecular SimulationsSkarmoutsos, Ioannis; Koukaras, Emmanuel N.; Klontzas, Emmanuel
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2021The Influence of Hydrophobic Blocks of PEO-Containing Copolymers on Glyceryl Monooleate Lyotropic Liquid Crystalline Nanoparticles for Drug DeliveryForys, Aleksander; Chountoulesi, Maria; Mendrek, Barbara; Konieczny, Tomasz; Sentoukas, Theodore; Godzierz, Marcin; Kordyka, Aleksandra; Demetzos, Costas; Pispas, Stergios; Trzebicka, Barbara
Open access
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2022The many-body expansion for metals. I. The alkaline earth metals Be, Mg, and CaMato, Joani; Tzeli, Demeter ; Xantheas, Sotiris S
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2025The Many-Body Expansion for Metals: II. Nonadditive Terms in Clusters Composed of Metals with ns1, ns2, and ns2p1 ConfigurationsTzeli, Demeter ; Mato, Joani; Xantheas, Sotiris S
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2022The Micellization of Well-defined Single Graft Copolymers in Block Copolymer/Homopolymer BlendsPavlopoulou, Eleni ; Chrissopoulou, Kiriaki ; Pispas, Stergios; Hadjichristidis, Nikos; Spiros H. Anastasiadis
Open access
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2021The Micellization of Well-Defined Single Graft Copolymers in Block Copolymer/Homopolymer BlendsPavlopoulou, Eleni; Chrissopoulou, Kiriaki; Pispas, Stergios; Hadjichristidis, Nikos; Anastasiadis, Spiros H.
Open access
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2023The nanostructure of polyelectrolyte complexes of QPDMAEMA-b-POEGMA copolymers and oppositely charged polyelectrolytes, and their stability in the presence of serum albuminRappoport, Sapir; Chrysostomou, Varvara; Pispas, Stergios; Talmon, Yeshayahu
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2015The need, benefits, and demonstration of a minimization principle for excited statesBacalis N.C.
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2021The Polar Cosolvent Effect on Caffeine Solvation in Supercritical CO2–Ethanol Mixtures: A Molecular Modeling ApproachSkarmoutsos, Ioannis; Petsalakis, Ioannis D.; Samios, Jannis
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2021The role of electric field, peripheral chains, and magnetic effects on significant 1H upfield shifts of the encapsulated molecules in chalcogen-bonded capsulesTzeli, Demeter; Petsalakis, Ioannis D.; Theodorakopoulos, Giannoula; Rahman, Faiz-Ur; Yu, Yang; Rebek, Julius
Open access
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2022The Role of Oxidation Pattern and Water Content in the Spatial Arrangement and Dynamics of Oxidized Graphene-Based Aqueous DispersionsRissanou, Anastassia; Karnis, Ioannis; Krasanakis, Fanourios; Chrissopoulou, Kiriaki; Karatasos, Konstantinos
Open access
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2014The role of the host-guest interactions in the relative stability of compressed encapsulated homodimers and heterodimers of amides and carboxylic acidsTzeli, Demeter; Petsalakis, I.D.; Theodorakopoulos G.; Ajami, D.; Rebek, J.
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2020The solvent effect on a styryl‐bodipy derivative functioning as an AND molecular logic gateTzeli, Demeter; Petsalakis, Ioannis D. ; Theodorakopoulos, Giannoula
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2010The State-Specific Expansion Approach to the Solution of the Polyelectronic Time-Dependent Schrodinger Equation for Atoms and Molecules in Unstable StatesΜερκούρης, Θεόδωρος Δ.; Κομνηνός, Γιάννης; Νικολαΐδης, Κλεάνθης A.
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2016The state-specific expansion approach to the solution of the time-dependent many-electron problemNicolaides C.A.
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Collection's Items (Sorted by Τίτλος in Αύξουσα order): 2201 to 2220 of 2616