Publications of E. K. U. Gross

Singh, N.; Elliott, P.; Dewhurst, J. K.; Gross, E. K. U.; Sharma, S.: Ab-initio real-time magnon dynamics in ferromagnetic and ferrimagnetic systems. Physica Status Solidi B 257 (7), 1900654 (2020)

Härkönen, V. J.; van Leeuwen, R.; Gross, E. K. U.: Many-body Green's function theory of electrons and nuclei beyond the Born-Oppenheimer approximation. Physical Review B 101 (23), 235153 (2020)

Elliott, P.; Singh, N.; Krieger, K.; Gross, E. K. U.; Sharma, S.; Dewhurst, J. K.: The microscopic origin of spin-orbit mediated spin-flips. Journal of Magnetism and Magnetic Materials 502, 166473 (2020)

Polyakov, O. P.; Gonoskov, I. A.; Stepanyuk, V. S.; Gross, E. K. U.: Generation of magnetic skyrmions by focused vortex laser pulses. Journal of Applied Physics 127 (7), 073904 (2020)

Lüders, M.; Cudazzo, P.; Profeta, G.; Continenza, A.; Massidda, S.; Sanna, A.; Gross, E. K. U.: Direct evaluation of the isotope effect within the framework of density functional theory for superconductors. Journal of Physics: Condensed Matter 31 (33), 334001 (2019)

Krishna, J.; Singh, N.; Shallcross, S.; Dewhurst, J. K.; Gross, E. K. U.; Maitra, T.; Sharma, S.: Complete description of the magnetic ground state in spinel vanadates. Physical Review B 100 (8), 081102 (2019)

Requist, R.; Proetto, C. R.; Gross, E. K. U.: Exact factorization-based density functional theory of electron-phonon systems. Physical Review B 99 (16), 165136 (2019)

Requist, R.; Gross, E. K. U.: Model Hamiltonian for strongly correlated systems: Systematic, self-consistent, and unique construction. Physical Review B 99 (12), 125114 (2019)

Agostini, F.; Gross, E. K. U.; Curchod, B. F. E.: Electron-nuclear entanglement in the time-dependent molecular wavefunction. Computational & Theoretical Chemistry 1151, pp. 99 - 106 (2019)

Chen, J.; Bovensiepen, U.; Eschenlohr, A.; Müller, T.; Elliott, P.; Gross, E. K. U.; Dewhurst, J. K.; Sharma, S.: Competing spin transfer and dissipation at Co/Cu(001) interfaces on femtosecond timescales. Physical Review Letters 122 (6), 067202 (2019)

Requist, R.; Gross, E. K. U.: Accurate formula for the macroscopic polarization of strongly correlated materials. The Journal of Physical Chemistry Letters 9 (24), pp. 7045 - 7051 (2018)

Dewhurst, J. K.; Shallcross, S.; Gross, E. K. U.; Sharma, S.: Substrate-controlled ultrafast spin injection and demagnetization. Physical Review Applied 10 (4), 044065 (2018)

Moreno Araneda, M.; Zacarias, A.; Velasquez, L.; Gonzalez, G.; Alegria-Arcos, M.; Gonzalez-Nilo, F.; Gross, E. K. U.: Experimental and theoretical structural/spectroscopical correlation of enterobactin and catecholamide. Data in Brief 20, pp. 2054 - 2064 (2018)

Moreno, M.; Zacarias, A.; Porzel, A.; Velasquez, L.; Gonzalez, G.; Alegria-Arcos, M.; Gonzalez-Nilo, F.; Gross, E. K. U.: IR and NMR spectroscopic correlation of enterobactin by DFT. Spectrochimica Acta, Part A: Molecular and Biomolecular Spectroscopy 198, pp. 264 - 277 (2018)

Dewhurst, J. K.; Elliott, P.; Shallcross, S.; Gross, E. K. U.; Sharma, S.: Laser-induced intersite spin transfer. Nano Letters 18 (3), pp. 1842 - 1848 (2018)

Li, C.; Requist, R.; Gross, E. K. U.: Density functional theory of electron transfer beyond the Born-Oppenheimer approximation: Case study of LiF. The Journal of Chemical Physics 148 (8), 084110 (2018)

Sanna, A.; Flores-Livas, J. A.; Davydov, A.; Profeta, G.; Dewhurst, K.; Sharma, S.; Gross, E. K. U.: Ab-initio Eliashberg theory: Making genuine predictions of superconducting features. Journal of the Physical Society of Japan 87 (4), 041012 (2018)

Sharma, S.; Gross, E. K. U.; Sanna, A.; Dewhurst, J. K.: Source-free exchange-correlation magnetic fields in density functional theory. Journal of Chemical Theory and Computation 14 (3), pp. 1247 - 1253 (2018)

Pototzky, K. J.; Zacarias, A.; Gross, E. K. U.: Controlling observables in normal, hybrid and Josephson junctions. Molecular Physics 116 (19-20), pp. 2449 - 2460 (2018)

Hader, K.; Albert, J.; Gross, E. K. U.; Engel, V.: Electron-nuclear wave-packet dynamics through a conical intersection. The Journal of Chemical Physics 146 (7), 074304 (2017)