Publikationen von 0000-0002-4279-8511
(ORCID: 0000-0002-4279-8511)

Graml, Maximilian und Wilhelm, Jan (2026) Data archive of "Optical excitations in nanographenes from the Bethe-Salpeter equation and time-dependent density functional theory: Absorption spectra and spatial descriptors" (PRB 2026). [Datensatz]

Iannuzzi, Marcella , Wilhelm, Jan , Stein, Frederick , Bussy, Augustin, Elgabarty, Hossam, Golze, Dorothea , Hehn, Anna-Sophia , Graml, Maximilian , Marek, Stepan , Gökmen, Beliz Sertcan, Schran, Christoph , Forbert, Harald, Khaliullin, Rustam Z. , Kozhevnikov, Anton, Taillefumier, Mathieu, Meli, Rocco , Rybkin, Vladimir V. , Brehm, Martin, Schade, Robert, Schütt, Ole , Pototschnig, Johann V. , Mirhosseini, Hossein, Knüpfer, Andreas, Marx, Dominik , Krack, Matthias , Hutter, Jürg und Kühne, Thomas D. (2026) The CP2K Program Package Made Simple. The Journal of Physical Chemistry B 130 (4), S. 1237-1310.

Pasquier, Rémi, Graml, Maximilian und Wilhelm, Jan (2025) Gaussian Basis Sets for All-Electron Excited-State Calculations of Large Molecules. Journal of Chemical Theory and Computation 22 (1), S. 540-557.

Roelcke, Carmen , Kastner, Lukas Z., Graml, Maximilian , Biereder, Andreas, Wilhelm, Jan , Repp, Jascha , Huber, Rupert und Gerasimenko, Yaroslav A. (2024) Ultrafast atomic-scale scanning tunnelling spectroscopy of a single vacancy in a monolayer crystal. Nature Photonics 18 (6), S. 595-602.

Roelcke, Carmen , Kastner, Lukas Z. , Graml, Maximilian , Biereder, Andreas, Wilhelm, Jan , Repp, Jascha , Huber, Rupert und Gerasimenko, Y. A. (2024) Data archive for: Ultrafast atomic-scale scanning tunnelling spectroscopy of a single vacancy in a monolayer crystal. [Datensatz]

Graml, Maximilian , Zollner, Klaus , Hernangómez-Pérez, Daniel, Faria Junior, Paulo E. und Wilhelm, Jan (2024) Data archive of "Low-Scaling GW Algorithm Applied to Twisted Transition-Metal Dichalcogenide Heterobilayers". [Datensatz]

Graml, Maximilian , Zollner, Klaus , Hernangómez-Pérez, Daniel, Faria Junior, Paulo E. und Wilhelm, Jan (2024) Low-Scaling GW Algorithm Applied to Twisted Transition-Metal Dichalcogenide Heterobilayers. Journal of Chemical Theory and Computation 20 (5), S. 2202-2208.