Electric response properties of neutral and charged Al13X (X=Li, Na, K) magic clusters. A comprehensive ab initio and density functional comparative study
Otero, Nicolás, Van Alsenoy, Christian, Karamanis, Panaghiotis, Pouchan, Claude
Published in Computational and theoretical chemistry (01.10.2013)
Published in Computational and theoretical chemistry (01.10.2013)
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Journal Article
Amphiphilic Gradient Copolymers Shape Composition Influence on the Surface/Bulk Properties
Karaky, Khaled, Billon, Laurent, Pouchan, Claude, Desbrières, Jacques
Published in Macromolecules (06.02.2007)
Published in Macromolecules (06.02.2007)
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Journal Article
Basis set and electron correlation effects in all-electron ab initio calculations of the static dipole polarizability of small cadmium selenide clusters, (CdSe) n , n = 1,2,3,4
Karamanis, Panaghiotis, Maroulis, George, Pouchan, Claude
Published in Chemical physics (11.12.2006)
Published in Chemical physics (11.12.2006)
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Journal Article
Ab-initio calculations of the IR spectra of dicyanodiacetylene (C6N2) beyond the harmonic approximation
Dargelos, Alain, Karamanis, Panaghiotis, Pouchan, Claude
Published in Chemical physics letters (16.05.2019)
Published in Chemical physics letters (16.05.2019)
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Journal Article
Electric Property Variations in Nanosized Hexagonal Boron Nitride/Graphene Hybrids
Karamanis, Panaghiotis, Otero, Nicolás, Pouchan, Claude
Published in Journal of physical chemistry. C (28.05.2015)
Published in Journal of physical chemistry. C (28.05.2015)
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Journal Article
Hirshfeld-based atomic population analysis of the B, N doping effect in zigzag graphene nanoribbons: $$\pi$$π electron density as requirement to follow the B, N doping guidelines
Otero, Nicolás, Karamanis, Panaghiotis, Pouchan, Claude
Published in Theoretical chemistry accounts (01.02.2018)
Published in Theoretical chemistry accounts (01.02.2018)
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Journal Article