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Paolo Giannozzi

Researcher at University of Udine

Publications -  125
Citations -  56379

Paolo Giannozzi is an academic researcher from University of Udine. The author has contributed to research in topics: Ab initio & Density functional theory. The author has an hindex of 38, co-authored 122 publications receiving 44408 citations. Previous affiliations of Paolo Giannozzi include Nest Labs & École Polytechnique Fédérale de Lausanne.

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Interfacial Engineering of P3HT/ZnO Hybrid Solar Cells Using Phthalocyanines: A Joint Theoretical and Experimental Investigation

TL;DR: In this article, a hybrid ternary model system based on a poly(3-hexylthiophene) (P3HT)/zinc phthalocyanine (ZnPc)/ZnO interface was used to study heterojunction interfaces of hybrid polymer solar cells, with the aim to better understand and precisely predict their photovoltaic properties.
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Structure and passivation effects of mono- and dihydrogen complexes in GaAsyN(1-y) alloys.

TL;DR: In GaAsyN(1-y), the presence of a few percent of N induces a large reduction of the GaAs band gap that vanishes upon hydrogenation, and a model is proposed that clarifies the passivation mechanism of nitrogen by H.
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Zinc Oxide-Zinc Phthalocyanine interface for Hybrid Solar Cells

TL;DR: In this article, the structural, electronic, and optical properties of a hybrid interface formed by zinc phthalocyanine (ZnPc) molecules adsorbed on the (1010) zinc oxide surface have been investigated by using ab initio and model potential theoretical methods.
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Theory of the metal-nonmagnetic Mott-Jahn-Teller insulator transition in A 4 C 60

TL;DR: In this paper, the authors studied the insulating properties of the Mott-Jahn-Teller (MJT) state in a nonmagnetic state, where conduction between molecules is blocked by on-site Coulomb repulsion, magnetism is suppressed by the intramolecular Jahn Teller effect, and important excitations (such as optical and spin gap) should be essentially intra-olecular.