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Low-density silicon allotropes for photovoltaic applications
Low-density silicon allotropes for photovoltaic applications
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Low-density silicon allotropes for photovoltaic applications

Amsler, Maximilian ; Botti, Silvana ; Marques, Miguel A. L. ; Lenosky, Thomas J. ; Goedecker, Stefan

Physical review. B, Condensed matter and materials physics, 2015-07, Vol.92 (1), Article 014101 [Periódico revisado por pares]

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2
Accuracy of generalized gradient approximation functionals for density-functional perturbation theory calculations
Accuracy of generalized gradient approximation functionals for density-functional perturbation theory calculations
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Accuracy of generalized gradient approximation functionals for density-functional perturbation theory calculations

He, Lianhua ; Liu, Fang ; Hautier, Geoffroy ; Oliveira, Micael J. T. ; Marques, Miguel A. L. ; Vila, Fernando D. ; Rehr, J. J. ; Rignanese, G.-M. ; Zhou, Aihui

Physical review. B, Condensed matter and materials physics, 2014-02, Vol.89 (6), Article 064305 [Periódico revisado por pares]

American Physical Society

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3
Low-energy silicon allotropes with strong absorption in the visible for photovoltaic applications
Low-energy silicon allotropes with strong absorption in the visible for photovoltaic applications
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Low-energy silicon allotropes with strong absorption in the visible for photovoltaic applications

Botti, Silvana ; Flores-Livas, José A. ; Amsler, Maximilian ; Goedecker, Stefan ; Marques, Miguel A. L.

Physical review. B, Condensed matter and materials physics, 2012-09, Vol.86 (12), Article 121204 [Periódico revisado por pares]

American Physical Society

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4
Self-trapping in B-doped amorphous Si: Intrinsic origin of low acceptor efficiency
Self-trapping in B-doped amorphous Si: Intrinsic origin of low acceptor efficiency
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Self-trapping in B-doped amorphous Si: Intrinsic origin of low acceptor efficiency

Santos, I. ; Castrillo, P. ; Windl, W. ; Drabold, D. A. ; Pelaz, L. ; Marqués, L. A.

Physical review. B, Condensed matter and materials physics, 2010-01, Vol.81 (3), Article 033203 [Periódico revisado por pares]

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5
Cluster-surface and cluster-cluster interactions: Ab initio calculations and modeling of asymptotic van der Waals forces
Cluster-surface and cluster-cluster interactions: Ab initio calculations and modeling of asymptotic van der Waals forces
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Cluster-surface and cluster-cluster interactions: Ab initio calculations and modeling of asymptotic van der Waals forces

Botti, Silvana ; Castro, Alberto ; Andrade, Xavier ; Rubio, Angel ; Marques, Miguel A. L.

Physical review. B, Condensed matter and materials physics, 2008-07, Vol.78 (3), Article 035333 [Periódico revisado por pares]

American Physical Society

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6
Superconductivity in layered binary silicides: A density functional theory study
Superconductivity in layered binary silicides: A density functional theory study
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Superconductivity in layered binary silicides: A density functional theory study

Flores-Livas, José A. ; Debord, Régis ; Botti, Silvana ; San Miguel, Alfonso ; Pailhès, Stéphane ; Marques, Miguel A. L.

Physical review. B, Condensed matter and materials physics, 2011-11, Vol.84 (18), Article 184503 [Periódico revisado por pares]

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7
Optical properties of Cu-chalcogenide photovoltaic absorbers from self-consistent GW and the Bethe-Salpeter equation
Optical properties of Cu-chalcogenide photovoltaic absorbers from self-consistent GW and the Bethe-Salpeter equation
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Optical properties of Cu-chalcogenide photovoltaic absorbers from self-consistent GW and the Bethe-Salpeter equation

Korbel, Sabine ; Kammerlancier, David ; Sarmiento-Perez, Rafael ; Attaccalite, Claudio ; Marques, Miguel A L ; Botti, Silvana

Physical review. B, Condensed matter and materials physics, 2015-02, Vol.91 (7) [Periódico revisado por pares]

American Physical Society

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8
Alloying effects on the optical properties of Ge1−xSix nanocrystals from time-dependent density functional theory and comparison with effective-medium theory
Alloying effects on the optical properties of Ge1−xSix nanocrystals from time-dependent density functional theory and comparison with effective-medium theory
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Alloying effects on the optical properties of Ge1−xSix nanocrystals from time-dependent density functional theory and comparison with effective-medium theory

Botti, Silvana ; Weissker, Hans-Christian ; A. L. Marques, Miguel

Physical review. B, Condensed matter and materials physics, 2009-04, Vol.79 [Periódico revisado por pares]

American Physical Society

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9
Carbon structures and defect planes in diamond at high pressure
Carbon structures and defect planes in diamond at high pressure
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Carbon structures and defect planes in diamond at high pressure

Botti, Silvana ; Amsler, Maximilian ; Flores-Livas, José A. ; Ceria, Paul ; Goedecker, Stefan ; Marques, Miguel A. L.

Physical review. B, Condensed matter and materials physics, 2013-07, Vol.88 (1), Article 014102 [Periódico revisado por pares]

American Physical Society

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10
Speeding up the solution of the Bethe-Salpeter equation by a double-grid method and Wannier interpolation
Speeding up the solution of the Bethe-Salpeter equation by a double-grid method and Wannier interpolation
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Speeding up the solution of the Bethe-Salpeter equation by a double-grid method and Wannier interpolation

Kammerlander, David ; Botti, Silvana ; Marques, Miguel A. L ; Marini, Andrea ; Attaccalite, Claudio

Physical review. B, Condensed matter and materials physics, 2012-09, Vol.86 (12), Article 125203

American Physical Society

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