Search Results - "Lekka, Ch" :: K.UTB vyhledávací portál | TBU Library Retrieval Portal

Complexation of Flavonoids with Iron: Structure and Optical Signatures

Complexation of Flavonoids with Iron: Structure and Optical Signatures

by Ren, Jun, Meng, Sheng, Lekka, Ch. E, Kaxiras, Efthimios
Published in The journal of physical chemistry. B (14.02.2008)

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Journal Article

Fe-Co magnetic nanoclusters by density functional theory calculations

Fe-Co magnetic nanoclusters by density functional theory calculations

by Cutrano, C. S., Lekka, Ch. E.
Published in Materials science and technology (02.09.2018)

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Journal Article

Structural, Electronic, and Optical Properties of Representative Cu−Flavonoid Complexes

Structural, Electronic, and Optical Properties of Representative Cu−Flavonoid Complexes

by Lekka, Ch. E, Ren, Jun, Meng, Sheng, Kaxiras, Efthimios
Published in The journal of physical chemistry. B (07.05.2009)

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Journal Article

The role of Sn doping in the β-type Ti-25 at%Nb alloys: Experiment and ab initio calculations

The role of Sn doping in the β-type Ti-25 at%Nb alloys: Experiment and ab initio calculations

by GUTIEERREZ-MORENO, J. J, GUO, Y, GEORGARAKIS, K, YAVARI, A. R, EVANGELAKIS, G. A, LEKKA, Ch. E
Published in Journal of alloys and compounds (15.01.2015)

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Conference Proceeding

Structural, magnetic and electronic properties of Cu-Fe nanoclusters by density functional theory calculations

Structural, magnetic and electronic properties of Cu-Fe nanoclusters by density functional theory calculations

by Cutrano, C.S., Lekka, Ch.E.
Published in Journal of alloys and compounds (15.06.2017)

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Journal Article

Structure, stability and bonding of ternary transition metal nitrides

Structure, stability and bonding of ternary transition metal nitrides

by Matenoglou, G.M., Koutsokeras, L.E, Lekka, Ch.E., Abadias, G., Kosmidis, C., Evangelakis, G.A., Patsalas, P.
Published in Surface & coatings technology (25.12.2009)

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Journal Article Conference Proceeding

Early Stages of Ti–O Cluster Growth on Carbon Nanotubes by ab Initio Calculations

Early Stages of Ti–O Cluster Growth on Carbon Nanotubes by ab Initio Calculations

by Gialampouki, M. A, Lekka, Ch. E
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (10.10.2013)

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Journal Article

Ab-initio and experimental study of phase stability of Ti-Nb alloys

Ab-initio and experimental study of phase stability of Ti-Nb alloys

by Gutiérrez Moreno, J.J., Bönisch, M., Panagiotopoulos, N.T., Calin, M., Papageorgiou, D.G., Gebert, A., Eckert, J., Evangelakis, G.A., Lekka, Ch.E.
Published in Journal of alloys and compounds (05.03.2017)

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Journal Article

Microalloying effects in ternary Cu-Zr-X (X=Be, Mg, Al, Si, P, Nb, Ag) icosahedral clusters and super-clusters from Density Functional Theory computations

Microalloying effects in ternary Cu-Zr-X (X=Be, Mg, Al, Si, P, Nb, Ag) icosahedral clusters and super-clusters from Density Functional Theory computations

by Bokas, G.B., Lekka, Ch.E., Papageorgiou, D.G., Evangelakis, G.A.
Published in Polyhedron (05.09.2017)

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Journal Article

Electronic origin and structural instabilities of Ti-based alloys suitable for orthopaedic implants

Electronic origin and structural instabilities of Ti-based alloys suitable for orthopaedic implants

by Lekka, Ch.E., Gutiérrez-Moreno, J.J., Calin, M.
Published in The Journal of physics and chemistry of solids (01.03.2017)

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Journal Article

On the microstructure of the Cu65Zr35 and Cu35Zr65 metallic glasses

On the microstructure of the Cu65Zr35 and Cu35Zr65 metallic glasses

by Almyras, G.A., Lekka, Ch.E., Mattern, N., Evangelakis, G.A.
Published in Scripta materialia (01.01.2010)

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Journal Article

Cu–Zr and Cu–Zr–Al clusters: Bonding characteristics and mechanical properties

Cu–Zr and Cu–Zr–Al clusters: Bonding characteristics and mechanical properties

by Lekka, Ch.E.
Published in Journal of alloys and compounds (01.08.2010)

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Journal Article

Bonding characteristics and strengthening of CuZr fundamental clusters upon small Al additions from density functional theory calculations

Bonding characteristics and strengthening of CuZr fundamental clusters upon small Al additions from density functional theory calculations

by Lekka, Ch.E., Evangelakis, G.A.
Published in Scripta materialia (01.11.2009)

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Journal Article

Ti N Decoration of Single-Wall Carbon Nanotubes and Graphene by Density Functional Theory Computations

Ti N Decoration of Single-Wall Carbon Nanotubes and Graphene by Density Functional Theory Computations

by Gialampouki, M. A, Lekka, Ch. E
Published in Journal of physical chemistry. C (11.08.2011)

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Journal Article

Structural characteristics of CuxZr100―x metallic glasses by Molecular Dynamics Simulations

Structural characteristics of CuxZr100―x metallic glasses by Molecular Dynamics Simulations

by LAGOGIANNI, A. E, ALMYRAS, G, LEKKA, Ch. E, PAPAGEORGIOU, D. G, EVANGELAKIS, G. A
Published in Journal of alloys and compounds (26.08.2009)

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Conference Proceeding Journal Article

Electronic and crystal structure and bonding in Ti-based ternary solid solution nitrides and Ti–Cu–N nanocomposite films

Electronic and crystal structure and bonding in Ti-based ternary solid solution nitrides and Ti–Cu–N nanocomposite films

by Patsalas, P., Abadias, G., Matenoglou, G.M., Koutsokeras, L.E., Lekka, Ch.E.
Published in Surface & coatings technology (25.11.2010)

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Journal Article Conference Proceeding

Modifications of CuxZr12-xY Icosahedra upon (0 < x < 12, Y = Be, Mg, Al, Si, P, Nb, Ag) substitutions by density functional theory computations

Modifications of CuxZr12-xY Icosahedra upon (0 < x < 12, Y = Be, Mg, Al, Si, P, Nb, Ag) substitutions by density functional theory computations

by BOKAS, G. B, EVANGELAKIS, G. A, LEKKA, Ch. e
Published in Computational materials science (01.07.2011)

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Journal Article

La dynamique de la politique européenne dans le Caucase

La dynamique de la politique européenne dans le Caucase

by Lekka, Anastasia Ch
Published in Cahiers balkaniques (Paris) (14.12.2018)

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Journal Article

Clustering, microalloying and mechanical properties in Cu/Zr-based glassy models by molecular dynamics simulations and ab-initio computations

Clustering, microalloying and mechanical properties in Cu/Zr-based glassy models by molecular dynamics simulations and ab-initio computations

by Lekka, Ch.E., Bokas, G.B., Almyras, G.A., Papageorgiou, D.G., Evangelakis, G.A.
Published in Journal of alloys and compounds (25.09.2012)

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Journal Article Conference Proceeding

On the role of Icosahedral-like clusters in the solidification and the mechanical response of Cu–Zr metallic glasses by Molecular Dynamics simulations and Density Functional Theory computations

On the role of Icosahedral-like clusters in the solidification and the mechanical response of Cu–Zr metallic glasses by Molecular Dynamics simulations and Density Functional Theory computations

by Bokas, G.B., Lagogianni, A.E., Almyras, G.A., Lekka, Ch.E., Papageorgiou, D.G., Evangelakis, G.A.
Published in Intermetallics (01.12.2013)

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Journal Article