Publication lists are available on Google Scholar for F. Evers (external link, opens in a new window) and J. Wilhelm (external link, opens in a new window).
- Floquet density response in laser-assisted fast-electron scattering from solids
F. Evers, S. Schäfer and R. Korytár,
arXiv: 2610.03416 (2026).
Full Text | PDF
Entry on the Publication Server
- CP2K: An electronic structure and molecular dynamics software package - Dynamics, Transport, and Spectroscopic Response
J. Wilhelm, A. Hehn, H. Elgabarty, B. Gökmen, M. Graml, S. Marek, R. Tyagi, F. Stein, J. Potoschnig, A. Bussy, C. Ahart, Z. Chen, L. Andersson, Z. Futera, F. Ivanovic, M. Buraschi, C. Schran, R. Pasquier, L. Prokisch, B. Samal, J. Schmitz, S. Shanbhag, H. Forbert, O. Schütt, F. Pöschl, S. Ehlert, S. Battaglia, M. Nottoli, B. Stamm, V. Voora, R. Khaliullin, S. Chulkov, M. Watkins, C. Cucinotta, J. Blumberger, C. Zhang, Y. Yang, D. Marx, M. Krack, J. Hutter, M. Iannuzzi and T. Kühne,
arXiv: 2607.22916 (2026).
Full Text | PDF
Entry on the Publication Server
- Imaging tip-induced isomerization of naphthalene and azulene moieties
J. Deyerling, T. Hung, N. Rey, R. Pasquier, L. Gross, J. Wilhelm, D. Peña and J. Repp,
Chemical Communications 62, 16202-16206 (2026).
Full Text | PDF
Entry on the Publication Server
- Roadmap on Advancements of the FHI-aims Software Package
J. Abbott, C. Mera Acosta, A. Akkoush, A. Ambrosetti, V. Atalla, A. Bagrets, J. Behler, D. Berger, H. Bertschi, B. Bieniek, J. Björk, V. Blum, S. Bohloul, C. Box, N. Boyer, D. Brambila, G. Bramley, K. Bryenton, M. Camarasa-Gómez, C. Carbogno, F. Caruso, S. Chutia, M. Ceriotti, G. Csányi, W. Dawson, F. Delesma, F. Della Sala, B. Delley, R. DiStasio, M. Dragoumi, S. Driessen, M. Dvorak, S. Erker, F. Evers, E. Fabiano, M. Farrow, F. Fiebig, J. Filser, L. Foppa, L. Gallandi, A. Garcia, R. Gehrke, S. Ghan, L. Ghiringhelli, M. Glass, S. Goedecker, D. Golze, M. Gramzow, J. Green, A. Grisafi, A. Grüneis, J. Günzl, S. Gutzeit, S. Hall, F. Hanke, V. Havu, X. He, J. Hekele, O. Hellman, U. Herath, J. Hermann, D. Hernangómez-Pérez, O. Hofmann, J. Hoja, S. Hollweger, L. Hörmann, B. Hourahine, W. How, W. Huhn, M. Hülsberg, T. Jacob, S. Panahian Jand, H. Jiang, E. Johnson, W. Jürgens, J. Kahk, Y. Kanai, K. Kang, P. Karpov, E. Keller, R. Kempt, D. Khan, M. Kick, B. Klein, J. Kloppenburg, A. Knoll, F. Knoop, F. Knuth, S. Köcher, J. Kockläuner, S. Kokott, T. Körzdörfer, H. Kowalski, P. Kratzer, P. Kus, R. Laasner, B. Lang, B. Lange, M. Langer, A. Larsen, H. Lederer, S. Lehtola, M. Lenz-Himmer, M. Leucke, S. Levchenko, A. Lewis, O. von Lilienfeld, K. Lion, W. Lipsunen, J. Lischner, Y. Litman, C. Liu, Q. Liu, S. Liu, A. Logsdail, M. Lorke, Z. Lou, I. Mandzhieva, A. Marek, J. Margraf, R. Maurer, T. Melson, F. Merz, J. Meyer, G. Michelitsch, T. Mizoguchi, E. Moerman, D. Morgan, J. Morgenstein, J. Moussa, A. Nair, L. Nemec, H. Oberhofer, A. Otero-de-la-Roza, R. Panadés-Barrueta, T. Patlolla, M. Pogodaeva, A. Pöppl, A. Price, T. Purcell, J. Quan, N. Raimbault, M. Rampp, K. Rasim, R. Redmer, X. Ren, K. Reuter, N. Richter, S. Ringe, P. Rinke, S. Rittmeyer, H. Rivera-Arrieta, M. Ropo, M. Rossi, V. Ruiz, N. Rybin, A. Sanfilippo, M. Scheffler, C. Scheurer, C. Schober, F. Schubert, T. Shen, C. Shepard, H. Shang, K. Shibata, A. Sobolev, R. Song, A. Soon, D. Speckhard, P. Stishenko, E. Stocco, M. Tahir, I. Takahara, J. Tang, Z. Tang, T. Theis, F. Theiss, A. Tkatchenko, M. Todorović, G. Trenins, O. Unke, Á. Vázquez-Mayagoitia, O. van Vuren, D. Waldschmidt, H. Wang, Y. Wang, J. Wieferink, J. Wilhelm, S. Woodley, J. Xu, Y. Xu, Y. Yao, Y. Yao, M. Yoon, V. Yu, Z. Yuan, M. Zacharias, I. Zhang, M. Zhang, W. Zhang, X. Zhang, R. Zhao, S. Zhao, R. Zhou, Y. Zhou and T. Zhu,
Electronic Structure (2026).
Full Text | PDF
Entry on the Publication Server
- Designing effective single-molecule electromagnets with radially π-conjugated carbon structures
W. Shi, R. Korytár, F. Evers, J. Tovar and L. Venkataraman,
Nature Communications 17, 7916 (2026).
Full Text | PDF
Entry on the Publication Server
- Optical excitations in nanographenes from the Bethe-Salpeter equation and time-dependent density functional theory: Absorption spectra and spatial descriptors
M. Graml and J. Wilhelm,
Physical Review B 113, 205152 (2026).
Full Text | PDF
Entry on the Publication Server
- Nonlinear Circular Dichroism Reveals the Local Berry Curvature
N. Tornow, P. Herrmann, C. Schneider, F. Evers, J. Wilhelm and G. Soavi,
arXiv: 2604.13729 (2026).
Full Text | PDF
Entry on the Publication Server
- Valleytronics in 2D Materials Roadmap
K. Seyler, G. Soavi, B. Weber, S. Das, A. Agarwal, I. Paradisanos, M. Glazov, O. Dogadov, F. Gucci, G. Cerullo, S. Dal Conte, S. Biswas, J. Wilhelm, I. Žutić, K. Denisov, T. Zhou, H. Zheng, W. Yao, H. Yu, T. Cao, D. Waters, M. Yankowitz, G. Burkard, A. Denisov, T. Ihn, K. Ensslin, L. Gaudreau, J. Boddison-Chouinard, Z. Fedorova, I. Staude, K. Goh, Z. Zhou and X. Li,
arXiv: 2603.01427 (2026).
Full Text | PDF
Entry on the Publication Server
- The CP2K Program Package Made Simple
M. Iannuzzi, J. Wilhelm, F. Stein, A. Bussy, H. Elgabarty, D. Golze, A. Hehn, M. Graml, S. Marek, B. Gökmen, C. Schran, H. Forbert, R. Khaliullin, A. Kozhevnikov, M. Taillefumier, R. Meli, V. Rybkin, M. Brehm, R. Schade, O. Schütt, J. Pototschnig, H. Mirhosseini, A. Knüpfer, D. Marx, M. Krack, J. Hutter and T. Kühne,
The Journal of Physical Chemistry B 130, 1237-1310 (2026).
Full Text | PDF
Entry on the Publication Server
- Probing Ultrafast Coherent Bandgap Modulation in Monolayer WSe2 by Nonlinear Optics
S. Klimmer, T. Lettau, L. Molina, D. Kartashov, U. Peschel, J. Wilhelm, D. Neshev and G. Soavi,
Advanced Optical Materials 14, e03236 (2025).
Full Text | PDF
Entry on the Publication Server
- Gaussian Basis Sets for All-Electron Excited-State Calculations of Large Molecules
R. Pasquier, M. Graml and J. Wilhelm,
Journal of Chemical Theory and Computation 22, 540-557 (2025).
Full Text | PDF
Entry on the Publication Server
- Efficient GW band structure calculations using Gaussian basis functions and application to atomically thin transition-metal dichalcogenides
R. Pasquier, M. Camarasa-Gómez, A. Hehn, D. Hernangómez-Pérez and J. Wilhelm,
Physical Review B (Editors’ Suggestion) 112, 205130 (2025).
Full Text | PDF
Entry on the Publication Server
- Measurement of optically induced broken time-reversal symmetry in atomically thin crystals
F. Friedrich, P. Herrmann, S. Shanbhag, S. Klimmer, J. Wilhelm and G. Soavi,
Nature Photonics 20, 186-193 (2025).
Full Text | PDF
Entry on the Publication Server
- Helical orbitals in electrical unidirectional molecular motors
S. Marek, W. Wulfhekel, F. Evers and R. Korytár,
Physical Review Research 8, 013270 (2025).
Full Text | PDF
Entry on the Publication Server
- Linear and Nonlinear Optical Properties of Molecules from Real-Time Propagation Based on the Bethe–Salpeter Equation
S. Marek and J. Wilhelm,
Journal of Chemical Theory and Computation 21, 9814-9822 (2025).
Full Text | PDF
Entry on the Publication Server
- Proximity-Driven Magnetic Coupling between an Open-Shell Nanographene and a Rare-Earth Surface Alloy
N. Bassi, J. Wilhelm, N. Krane, F. Xiang, P. Čmelová, E. Turco, P. Gargiani, C. Pignedoli, M. Juríček, R. Fasel, R. Korytár and P. Ruffieux,
ACS Nano 19, 33868-33878 (2025).
Entry on the Publication Server
- Unconventional Electromechanical Response in Ferrocene-Assisted Gold Atomic Chain
B. Pabi, S. Marek, T. Klein, A. Thakur, R. Korytár and A. Nath Pal,
Nano Letters 25, 13511-13518 (2025).
Full Text | PDF
Entry on the Publication Server
- Roadmap for Photonics with 2D Materials
F. de Abajo, D. Basov, F. Koppens, L. Orsini, M. Ceccanti, S. Castilla, L. Cavicchi, M. Polini, P. Gonçalves, A. Costa, N. Peres, N. Mortensen, S. Bharadwaj, Z. Jacob, P. Schuck, A. Pasupathy, M. Delor, M. Liu, A. Mugarza, P. Merino, M. Cuxart, E. Chávez-Angel, M. Švec, L. Tizei, F. Dirnberger, H. Deng, C. Schneider, V. Menon, T. Deilmann, A. Chernikov, K. Thygesen, Y. Abate, M. Terrones, V. Sangwan, M. Hersam, L. Yu, X. Chen, T. Heinz, P. Murthy, M. Kroner, T. Smolenski, D. Thureja, T. Chervy, A. Genco, C. Trovatello, G. Cerullo, S. Dal Conte, D. Timmer, A. De Sio, C. Lienau, N. Shang, H. Hong, K. Liu, Z. Sun, L. Rozema, P. Walther, A. Alù, A. Marini, M. Cotrufo, R. Queiroz, X. Zhu, J. Cox, E. Dias, Á. Echarri, F. Iyikanat, P. Herrmann, N. Tornow, S. Klimmer, J. Wilhelm, G. Soavi, Z. Sun, S. Wu, Y. Xiong, O. Matsyshyn, R. Krishna Kumar, J. Song, T. Bucher, A. Gorlach, S. Tsesses, I. Kaminer, J. Schwab, F. Mangold, H. Giessen, M. Sánchez, D. Efetov, T. Low, G. Gómez-Santos, T. Stauber, G. Álvarez-Pérez, J. Duan, L. Martín-Moreno, A. Paarmann, J. Caldwell, A. Nikitin, P. Alonso-González, N. Mueller, V. Volkov, D. Jariwala, T. Shegai, J. van de Groep, A. Boltasseva, I. Bondarev, V. Shalaev, J. Simon, C. Fruhling, G. Shen, D. Novko, S. Tan, B. Wang, H. Petek, V. Mkhitaryan, R. Yu, A. Manjavacas, J. Ortega, X. Cheng, R. Tian, D. Mao, D. Van Thourhout, X. Gan, Q. Dai, A. Sternbach, Y. Zhou, M. Hafezi, D. Litvinov, M. Grzeszczyk, K. Novoselov, M. Koperski, S. Papadopoulos, L. Novotny, L. Viti, M. Vitiello, N. Cottam, B. Dewes, O. Makarovsky, A. Patanè, Y. Song, M. Cai, J. Chen, D. Naveh, H. Jang, S. Park, F. Xia, P. Jenke, J. Bajo, B. Braun, K. Burch, L. Zhao and X. Xu,
ACS Photonics 12, 3961-4095 (2025).
Full Text | PDF
Entry on the Publication Server
- An electrical molecular motor driven by angular momentum transfer
J. Skolaut, S. Marek, N. Balzer, M. Camarasa-Gómez, J. Wilhelm, J. Lukášek, M. Valášek, L. Gerhard, F. Evers, M. Mayor, W. Wulfhekel and R. Korytár,
arXiv: 2503.05351 (2025).
Full Text | PDF
Entry on the Publication Server
- Perturbative spin–orbit couplings for the simulation of extended framework materials
J. Vogt, J. Wilhelm and A. Hehn,
The Journal of Chemical Physics 162, 082502 (2025).
Full Text | PDF
Entry on the Publication Server
- Nonlinear valley selection rules and all-optical probe of broken time-reversal symmetry in monolayer WSe2
P. Herrmann, S. Klimmer, T. Lettau, T. Weickhardt, A. Papavasileiou, K. Mosina, Z. Sofer, I. Paradisanos, D. Kartashov, J. Wilhelm and G. Soavi,
Nature Photonics 19, 300-306 (2025).
Full Text | PDF
Entry on the Publication Server
- The role of Berry curvature derivatives in the optical activity of time-invariant crystals
G. Soavi and J. Wilhelm,
arXiv: 2501.03684 (2025).
Full Text | PDF
Entry on the Publication Server
- Minimal model of inelastic tunneling of vibrating magnetic molecules on superconducting substrates
A. Koliogiorgos and R. Korytár,
Physical Review B 110, 235424 (2024).
Full Text | PDF
Entry on the Publication Server
- Giant DC-like residual current generated by subcycle laser pulses
A. Seith, F. Evers and J. Wilhelm,
Physical Review Research 6, 043149 (2024).
Full Text | PDF
Entry on the Publication Server
- Spin conductances and magnetization production in chiral molecular junctions
R. Korytár, J. van Ruitenbeek and F. Evers,
The Journal of Chemical Physics 161, 094111 (2024).
Full Text | PDF
Entry on the Publication Server