Layla Martin‐Samos

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

Paolo Giannozzi, Stefano Baroni, Nicola Bonini et al. · Journal of Physics Condensed Matter · 2009 · 28K citations · Full text

Engineering, Material Simulation, Computational Chemistry +19

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

Sylvain Girard, A. Alessi, N. Richard et al. · Reviews in Physics · 2019 · 332 citations · Full text

Effect of Molecular Packing on Corannulene-Based Materials Electroluminescence

Laura Zoppi, Layla Martin‐Samos, Kim K. Baldridge · Journal of the American Chemical Society · 2011 · 84 citations

Optical Materials, Engineering, Chemistry +21

Neutral self-defects in a silica model: A first-principles study

Layla Martin‐Samos, Yves Limoge, Jean-Paul Crocombette et al. · Physical Review B · 2005 · 57 citations

Materials Science, Glass-ceramic, Engineering +15

Enhancement of DFT-calculations at petascale: Nuclear Magnetic Resonance, Hybrid Density Functional Theory and Car–Parrinello calculations

Nicola Varini, Davide Ceresoli, Layla Martin‐Samos et al. · Computer Physics Communications · 2013 · 44 citations · Full text

Physics, Car–parrinello Calculations, Magnetic Resonance +4