Time-dependent density-functional theory.
By Á. Rubio, Miguel A. L. Marques. Physical Chemistry, Chemical Physics - PCCP, 2009
1,151 citations recorded by the source corpus.
Subfields: Materials Chemistry, Physical and Theoretical Chemistry
View Paper: https://www.semanticscholar.org/paper/3be90b8795d8aaa845182ef332eaf45581485863
How researchers see this paper
The researchers whose trusted networks rank it highest, strongest advocate first. Every researcher gets a different order.
In Materials Chemistry
- Gian-Marco Rignanese
- Marc Torrent
- Xavier Gonze
- Matthieu J. Verstraete
- Matteo Giantomassi
- Kazuhiro Yabana
- T. Nakatsukasa
- Bernard Amadon
In Physical and Theoretical Chemistry
- Kazuhiro Yabana
- T. Nakatsukasa
- M. Matsuo
- K. Matsuyanagi
- Ester Livshits
- Ulrike Salzner
- Roi Baer
- Á. Rubio
Citations in the corpus
- Quantum electrodynamical density-functional theory: Bridging quantum optics and electronic-structure theory (2014, methodology): “In [67] functionals based on an optimized effective potential approach [9, 10] are constructed, which provide good results even in the situation of strongly-coupled systems.”
- QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials (2009, neutral): “Many of the soon-to-come additions will deal with excited-state calculations within time-dependent DFT (TDDFT [172, 173]) and/or many-body perturbation theory [174].”
- ABINIT: First-principles approach to material and nanosystem properties (2009, background): “In the case of open shell systems TDDFT-ALDA is known to suffer from the spin contamination problem [159], which could only be solved by inclusion of double excitations.”
- Colloquium: Nonthermal pathways to ultrafast control in quantum materials (2021, methodology): “Time-dependent density functional theory (TDDFT) is an extension of ground-state density functional theory, with similar merits and challenges (Marques et al., 2012; Ullrich, 2012).”
- Time-dependent density-functional description of nuclear dynamics (2016, methodology): “Attempts to formulate a LACM theory without assuming adiabaticity of large-amplitude collective motion were initiated by Rowe and Bassermann (1976) and Marumori (1977) and led to the formulation of the self-consistent collective coordinate (SCC) method (Marumori et al., 1980). In these approaches, c”
- Tuned range-separated hybrids in density functional theory. (2010, background): “Then set IP k = IP 1 + ν k − 1, (k = 2, 3, . . . ), where ν k is the cation k-th excitation energy, calculated with TDDFT (or time-dependent HF).”