Search Results - "Cecilia Vona"

Chirality of Valley Excitons in Monolayer Transition-Metal Dichalcogenides by Caruso, Fabio, Schebek, Maximilian, Pan, Yiming, Vona, Cecilia, Draxl, Claudia

“…By enabling control of valley degrees of freedom in transition-metal dichalcogenides, valley-selective circular dichroism has become a key concept in…”
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Electronic Structure of (Organic‐)Inorganic Metal Halide Perovskites: The Dilemma of Choosing the Right Functional by Vona, Cecilia, Nabok, Dmitrii, Draxl, Claudia

“…Organic–inorganic metal halide perovskites (HaPs) are intensively studied for their light‐harvesting properties. Owing to the interplay between strong…”
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Excitons at the Phase Transition of 2D Hybrid Perovskites by Ziegler, Jonas D., Lin, Kai-Qiang, Meisinger, Barbara, Zhu, Xiangzhou, Kober-Czerny, Manuel, Nayak, Pabitra K., Vona, Cecilia, Taniguchi, Takashi, Watanabe, Kenji, Draxl, Claudia, Snaith, Henry J., Lupton, John M., Egger, David A., Chernikov, Alexey

“…2D halide perovskites are among intensely studied materials platforms profiting from solution-based growth and chemical flexibility. They feature exceptionally…”
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Critical assessment of G 0 W 0 calculations for 2D materials: the example of monolayer MoS2 by Ronaldo Rodrigues Pela, Cecilia Vona, Sven Lubeck, Ben Alex, Ignacio Gonzalez Oliva, Claudia Draxl

“…Abstract Two-dimensional (2D) materials combine many fascinating properties that make them more interesting than their three-dimensional counterparts for a…”
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Critical assessment of G0W0 calculations for 2D materials: the example of monolayer MoS2 by Rodrigues Pela, Ronaldo, Vona, Cecilia, Lubeck, Sven, Alex, Ben, Gonzalez Oliva, Ignacio, Draxl, Claudia

“…Two-dimensional (2D) materials combine many fascinating properties that make them more interesting than their three-dimensional counterparts for a variety of…”
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Electronic structure of (organic-)inorganic metal halide perovskites: the dilemma of choosing the right functional by Vona, Cecilia, Nabok, Dmitrii, Draxl, Claudia

“…Organic-inorganic metal halide perovskites (HaPs) are intensively studied for their light-harvesting properties. Owing to the interplay between strong…”
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Accurate and efficient treatment of spin-orbit coupling via second variation employing local orbitals by Vona, Cecilia, Lubeck, Sven, Kleine, Hannah, Gulans, Andris, Draxl, Claudia

“…A new method is presented that allows for efficient evaluation of spin-orbit coupling (SOC) in density-functional theory calculations. In the so-called…”
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Critical assessment of $G_0W_0$ calculations for 2D materials: the example of monolayer MoS$_2 by Pela, Ronaldo Rodrigues, Vona, Cecilia, Lubeck, Sven, Alex, Ben, Oliva, Ignacio Gonzalez, Draxl, Claudia

“…npj Comput Mater 10, 77 (2024) Two-dimensional (2D) materials combine many fascinating properties that make them more interesting than their three-dimensional…”
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Chirality of Valley Excitons in Monolayer Transition-Metal Dichalcogenides by Caruso, Fabio, Schebek, Maximilian, Pan, Yiming, Vona, Cecilia, Draxl, Claudia

“…By enabling control of valley degrees of freedom in transition-metal dichalcogenides, valley-selective circular dichroism has become a key concept in…”
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Similarity of materials and data-quality assessment by fingerprinting by Kuban, Martin, Gabaj, Šimon, Aggoune, Wahib, Vona, Cecilia, Rigamonti, Santiago, Draxl, Claudia

“…Identifying similar materials, i.e., those sharing a certain property or feature, requires interoperable data of high quality. It also requires means to…”
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Fingerprints of optical absorption in the perovskite LaInO$_{3}$: Insight from many-body theory and experiment by Aggoune, Wahib, Irmscher, Klaus, Nabok, Dmitrii, Vona, Cecilia, Anooz, Saud Bin, Galazka, Zbigniew, Albrecht, Martin, Draxl, Claudia

“…Phys. Rev. B 103, 115105 (2021) We provide a combined theoretical and experimental study of the electronic structure and the optical absorption edge of the…”
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Robust excitons across the phase transition of two-dimensional hybrid perovskites by Ziegler, Jonas D, Lin, Kai-Qiang, Meisinger, Barbara, Zhu, Xiangzhou, Kober-Czerny, Manuel, Nayak, Pabitra K, Vona, Cecilia, Taniguchi, Takashi, Watanabe, Kenji, Draxl, Claudia, Snaith, Henry J, Lupton, John M, Egger, David A, Chernikov, Alexey

“…Two-dimensional halide perovskites are among intensely studied materials platforms profiting from solution based growth and chemical flexibility. They feature…”
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