✦ LIBER ✦

Describing static correlation in bond dissociation by Kohn–Sham density functional theory

✍ Scribed by Fuchs, M.; Niquet, Y.-M.; Gonze, X.; Burke, K.

Book ID: 121826416
Publisher: American Institute of Physics
Year: 2005
Tongue: English
Weight: 341 KB
Volume: 122
Category: Article
ISSN: 0021-9606
DOI: 10.1063/1.1858371

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Strong Correlation in Kohn-Sham Density

Strong Correlation in Kohn-Sham Density Functional Theory

✍ Malet, Francesc; Gori-Giorgi, Paola 📂 Article 📅 2012 🏛 The American Physical Society 🌐 English ⚖ 376 KB

Kohn-Sham density functional theory for

Kohn-Sham density functional theory for quantum wires in arbitrary correlation regimes

✍ Malet, Francesc; Mirtschink, André; Cremon, Jonas C.; Reimann, Stephanie M.; Gor 📂 Article 📅 2013 🏛 The American Physical Society 🌐 English ⚖ 934 KB

Study of correlation in Kohn—Sham densit

Study of correlation in Kohn—Sham density functional theory for exactly solvable two-electron systems

✍ Alok Samanta; Swapan K. Ghosh 📂 Article 📅 1991 🏛 Elsevier Science 🌐 English ⚖ 496 KB

A relativistic Kohn–Sham density functio

A relativistic Kohn–Sham density functional procedure by means of direct perturbation theory. II. Application to the molecular structure and bond dissociation energies of transition metal carbonyls and related complexes

✍ van Wüllen, Christoph 📂 Article 📅 1996 🏛 American Institute of Physics 🌐 English ⚖ 431 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