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Ab initiocomplex band structure of conjugated polymers: Effects of hydrid density functional theory andGWschemes

scholarly article in Physical Review B, vol. 85 no. 23, June 2012

Collective dipole effects in ionic transport under electric fields

artículo científico publicado en 2020

Effect of molecular packing on corannulene-based materials electroluminescence

artículo científico publicado en 2011

Finding reaction pathways and transition states: r-ARTn and d-ARTn as an efficient and versatile alternative to string approaches

artículo científico publicado en 2020

Optical Properties of Saturated and Unsaturated Carbonyl Defects in Polyethylene.

artículo científico publicado en 2018

Overview of radiation induced point defects in silica-based optical fibers

artículo científico publicado en 2019

QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials

artículo científico publicado en 2009

SaX: An open source package for electronic-structure and optical-properties calculations in the GW approximation

Structure-property relationships of curved aromatic materials from first principles.

artículo científico publicado en 2014

Study of silica-based intrinsically emitting nanoparticles produced by an excimer laser

scientific article published on 16 January 2019

Unraveling effects of disorder on the electronic structure ofSiO2from first principles

scholarly article in Physical Review B, vol. 81 no. 8, February 2010

v-PO micro-clustering in P-doped silica studied by a first-principles Raman investigation

scientific article published on 09 May 2019

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