Materials Science · Physics
On the density-potential mapping in time-dependent density functional theory
Neepa T. Maitra, Tchavdar N. Todorov, Chris Woodward, Kieron Burke
2015-05-14
Quantum Physics · Physics
Computational complexity of time-dependent density functional theory
J. D. Whitfield, M. -H. Yung, D. G. Tempel, S. Boixo +1
2014-08-22
Materials Science · Physics
Time-dependent density-functional theory approach to nonlinear particle-solid interactions in comparison with scattering theory
V. U. Nazarov, J. M. Pitarke, C. S. Kim, Y. Takada
2009-11-10
Strongly Correlated Electrons · Physics
Exact time-dependent density-functional potentials for strongly correlated tunneling electrons
Matthew J. P. Hodgson, James D. Ramsden, Jacob B. J. Chapman, Piers Lillystone +1
2021-01-15
Materials Science · Physics
Time-Dependent Density Functional Theory for Open Quantum Systems with Unitary Propagation
Joel Yuen-Zhou, David G. Tempel, César Rodríguez-Rosario, Alán Aspuru-Guzik
2011-02-09
Analysis of PDEs · Mathematics
Existence and uniqueness of solutions to the time-dependent Kohn-Sham equations coupled with classical nuclear dynamics
Björn Baumeier, Onur Çaylak, Carlo Mercuri, Mark Peletier +2
2024-02-14
Computational Physics · Physics
An efficient algorithm for time propagation within time-dependent density functional theory
J. K. Dewhurst, K. Krieger, S. Sharma, E. K. U. Gross
2014-12-03
Computational Physics · Physics
Identification and Resolution of Unphysical Multielectron Excitations in the Real-Time Time-Dependent Kohn-Sham Formulation
Xiaoning Zang, Udo Schwingenschlogl, Mark T. Lusk
2020-01-16
Quantum Physics · Physics
Time-dependent density-functional theory for open systems
Xiao Zheng, Fan Wang, Chi Yung Yam, Yan Mo +1
2009-11-13
Chemical Physics · Physics
Kohn-Sham calculations with the exact functional
Lucas O. Wagner, Thomas E. Baker, E. M. Stoudenmire, Kieron Burke +1
2014-07-14