Physics – Condensed Matter – Materials Science
Scientist
Physics
Condensed Matter
Materials Science
Scientist
Electronic levels and electrical response of periodic molecular structures from plane-wave orbital-dependent calculations
Electrostatics in Periodic Boundary Conditions and Real-space Corrections
Koopmans' condition for density-functional theory
Non-Koopmans Corrections in Density-functional Theory: Self-interaction Revisited
Quantum ESPRESSO: a modular and open-source software project for quantum simulations of materials
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