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The obliquity and atmosphere of the ultra-hot Jupiter TOI-1431b (MASCARA-5b): A misaligned orbit and no signs of atomic or molecular absorptions2021 Astronomy and Astrophysics article Physics and Astronomy Stellar, planetary, and galactic studies Open access
M. Stangret, Ε. Πάλλη, N. Casasayas-Barris, M. Oshagh, Aaron Bello-Arufe, R. Luque, +18 more
25citations -
Spatial distribution of atomic electronic density for elements 1 to 54 as coming from a Hartree-Fock treatment within the minimum atomic parameters (MAP) paradigm.0citations
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LOBSTER : Local orbital projections, atomic charges, and chemical‐bonding analysis from projector‐augmented‐wave‐based density‐functional theory2020 Journal of Computational Chemistry article Physics and Astronomy Advanced Chemical Physics Studies Open access
Ryky Nelson, Christina Ertural, Janine George, Volker L. Deringer, Geoffroy Hautier, Richard Dronskowski
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Generalization of Intrinsic Orbitals to Kramers-Paired Quaternion Spinors, Molecular Fragments, and Valence Virtual Spinors2021 Journal of Chemical Theory and Computation article Physics and Astronomy Advanced Chemical Physics Studies Open access
Bruno Senjean, Souloke Sen, Michal Repiský, Gerald Knizia, Lucas Visscher
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Inside Back Cover: The Orbital Origins of Chemical Bonding in Ge−Sb−Te Phase‐Change Materials (Angew. Chem. Int. Ed. 17/2022)2022 Angewandte Chemie International Edition article Materials Science Phase-change materials and chalcogenides
Jan Hempelmann, Peter C. Müller, Christina Ertural, Richard Dronskowski
0citations