activity
20182020
most citedThe CECAM Electronic Structure Library and the modular software development paradigm

34 citations · 34 across the 1 of their papers we have counts for

collaborators

5 papers

cond-mat.mtrl-sci202034 cited

The CECAM Electronic Structure Library and the modular software development paradigm

Micael J. T. Oliveira, Nick Papior, Yann Pouillon +34

First-principles electronic structure calculations are very widely used thanks to the many successful software packages available. Their traditional coding paradigm is monolithic,…

physics.comp-ph2019

Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems

Nicolas Tancogne-Dejean, Micael J. T. Oliveira, Xavier Andrade +31

Over the last years extraordinary advances in experimental and theoretical tools have allowed us to monitor and control matter at short time and atomic scales with a high-degree of…

cond-mat.mtrl-sci2019

Computational generation of voids in -Si and -Si:H by cavitation at low density

Enrique Guerrero, David A. Strubbe

Use of amorphous silicon (-Si) and hydrogenated amorphous silicon (-Si:H) in photovoltaics has been limited by light-induced degradation (the Staebler-Wronski effect) and low…

cond-mat.mtrl-sci2019

Solid Lubrication with MoS: A Review

Mohammad R. Vazirisereshk, Ashlie Martini, David A. Strubbe +1

Molybdenum disulfide (MoS) is one of the most broadly utilized solid lubricants with a wide range of applications, including but not limited to those in the aerospace/space ind…

cond-mat.mtrl-sci2018

Thermodynamic limits to energy conversion in solar thermal fuels

David A Strubbe, Jeffrey C Grossman

Solar thermal fuels (STFs) are an unconventional paradigm for solar energy conversion and storage which is attracting renewed attention. In this concept, a material absorbs sunligh…