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ΤύποςΗμερομηνίαΤίτλοςΔημιουργόςΠλήρες κείμενο
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2007Theoretical investigation on the electronic and geometric structure of GaN2+ and GaN4+Tzeli, Demeter; Petsalakis, Ioannis D.; Theodorakopoulos, Giannoula
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2008A DFT Study of Adsorption of Gallium and Gallium Nitrides on Si(111)Tzeli, Demeter; Θεοδωρακοπούλου, Γιαννούλα; Πετσαλάκης, Ιωάννης Δ.
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2008Structure and energetics of InN and GaN dimersSimova, Lucia; Tzeli, Demeter; Urban, Miroslav; Cernusak, Ivan; Θεοδωρακοπούλου, Γιαννούλα; Πετσαλάκης, Ιωάννης Δ.
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2008Theoretical study on the electronic states of NaLiPetsalakis, Ioannis; Tzeli, Demeter ; Theodorakopoulos, Giannoula
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2008Theoretical study of gallium nitride molecules, GaN2 and GaN4Tzeli, Demeter; Θεοδωρακοπούλου, Γιαννούλα; Πετσαλάκης, Ιωάννης Δ.
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2009Theoretical Study of Adsorption of Group IIIA Nitrides on Si(111)Tzeli, Demeter; Πετσαλάκης, Ιωάννης Δ.; Θεοδωρακοπούλου, Γιαννούλα
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2009Theoretical Study of Adsorption and Diffusion of Group IIIA Metals on Si(111)Tzeli, Demeter; Πετσαλάκης, Ιωάννης Δ.; Θεοδωρακοπούλου, Γιαννούλα
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2009Theoretical investigation of the ground and low-lying excited states of gallium and indium silicides, GaSi and InSiTzeli, Demeter ; Πετσαλάκης, Ιωάννης Δ.; Θεοδωρακοπούλου, Γιαννούλα
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2011Electronic structure and absorption spectra of supramolecular complexes of a fullerene crown ether with a pi-extended TTF derivativeTzeli, Demeter; Πετσαλάκης, Ιωάννης Δ.; Θεοδωρακοπούλου, Γιαννούλα
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2011Theoretical investigation of the complexation of crown ethers and crown ethers of fulleropyrrolidine with (CH3)(x)NH4-x+, x=0-4Tzeli, Demeter; Πετσαλάκης, Ιωάννης Δ.; Θεοδωρακοπούλου, Γιαννούλα
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2011Theoretical study on the electronic structure and the absorption spectra of complexes of C-60 and C59N with pi-extended derivatives of tetrathiafulvaleneΠετσαλάκης, Ιωάννης Δ.; Tzeli, Demeter; Kerkines, Ioannis S. K.; Θεοδωρακοπούλου, Γιαννούλα
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2011Theoretical Study of Hydrogen Bonding in Homodimers and Heterodimers of Amide, Boronic Acid, and Carboxylic Acid, Free and in Encapsulation ComplexesTzeli, Demeter; Θεοδωρακοπούλου, Γιαννούλα; Πετσαλάκης, Ιωάννης Δ.; Ajami, Dariush; Rebek, Julius
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2011Computational Insight into the Electronic Structure and Absorption Spectra of Lithium Complexes of N-Confused TetraphenylporphyrinTzeli, Demeter; Πετσαλάκης, Ιωάννης Δ.; Θεοδωρακοπούλου, Γιαννούλα
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2012A Theoretical Study of Complexes of Crown Ethers with Substituted Ammonium CationsTzeli, Demeter; Πετσαλάκης, Ιωάννης Δ.; Θεοδωρακοπούλου, Γιαννούλα
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2012Conformations and Fluorescence of Encapsulated StilbeneTzeli, Demeter ; Θεοδωρακοπούλου, Γιαννούλα; Πετσαλάκης, Ιωάννης Δ.; Ajami, Dariush; Rebek, Julius, Jr.
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2013Theoretical study on the electronic structure, formation and absorption spectra of lithium, sodium and potassium complexes of N-confused tetraphenylporphyrinTzeli, D.; Petsalakis I.D.; Theodorakopoulos G.
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2013Compression in encapsulated carboxylic acid homodimersTzeli, D.; Petsalakis I.D.; Theodorakopoulos G.
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2013Theoretical study of free and encapsulated carboxylic acid and amide dimersTzeli, D.; Petsalakis I.D.; Theodorakopoulos G.; Ajami D.; Rebek Jr. J.
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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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2014Arene-fused 1,2-oxazole N-oxides and derivatives. the impact of the N-O dipole and substitution on their aromatic character and reactivity profile. Can it be a useful structure in synthesis? A theoretical insightKozielewicz P.; Tzeli, D.; Tsoungas P.G.; Zloh M.
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