✦ LIBER ✦

Time-dependent Kohn-Sham density-functional theory

✍ Scribed by Bartolotti, Libero J.

Book ID: 121675133
Publisher: The American Physical Society
Year: 1982
Tongue: English
Weight: 87 KB
Volume: 26
Category: Article
ISSN: 1050-2947
DOI: 10.1103/PhysRevA.26.2243

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

The hydrodynamic formulation of time-dep

The hydrodynamic formulation of time-dependent Kohn-Sham orbital density functional theory

✍ Bartolotti, Libero J. 📂 Article 📅 1986 🏛 American Chemical Society 🌐 English ⚖ 783 KB

Adiabatic approximation within time-depe

Adiabatic approximation within time-dependent density functional theory using inversion of the ground-state spin-density Kohn–Sham formalism

✍ Ingo Dreissigacker; Manfred Lein 📂 Article 📅 2011 🏛 Elsevier Science 🌐 English ⚖ 301 KB

A density matrix-based quasienergy formu

A density matrix-based quasienergy formulation of the Kohn–Sham density functional response theory using perturbation- and time-dependent basis sets

✍ Thorvaldsen, Andreas J.; Ruud, Kenneth; Kristensen, Kasper; Jo̸rgensen, Poul; Co 📂 Article 📅 2008 🏛 American Institute of Physics 🌐 English ⚖ 675 KB

Nonadiabatic couplings from the Kohn-Sha

Nonadiabatic couplings from the Kohn-Sham derivative matrix: Formulation by time-dependent density-functional theory and evaluation in the pseudopotential framework

✍ Hu, Chunping; Sugino, Osamu; Hirai, Hirotoshi; Tateyama, Yoshitaka 📂 Article 📅 2010 🏛 The American Physical Society 🌐 English ⚖ 388 KB

Qualitatively Correct Charge-Transfer Ex

Qualitatively Correct Charge-Transfer Excitation Energies in HeH + by Time-Dependent Density-Functional Theory Due to Exact Exchange Kohn−Sham Eigenvalue Differences

✍ Gimon, Tino; Ipatov, Andrey; Heßelmann, Andreas; Görling, Andreas 📂 Article 📅 2009 🏛 American Chemical Society 🌐 English ⚖ 211 KB

[Challenges and Advances in Computationa

[Challenges and Advances in Computational Chemistry and Physics] Non-Linear Optical Properties of Matter Volume 1 || Kohn–Sham Time-Dependent Density Functional Theory with Applications to Linear and Nonlinear Properties

✍ Papadopoulos, Manthos G.; Sadlej, Andrzej J.; Leszczynski, Jerzy 📂 Article 📅 2006 🏛 Springer Netherlands ⚖ 740 KB