✦ LIBER ✦

Linear-scaling time-dependent density-functional theory

✍ Scribed by Yam, ChiYung; Yokojima, Satoshi; Chen, GuanHua

Book ID: 120340316
Publisher: The American Physical Society
Year: 2003
Tongue: English
Weight: 46 KB
Volume: 68
Category: Article
ISSN: 1098-0121
DOI: 10.1103/PhysRevB.68.153105

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Towards excitation energies and (hyper)p

Towards excitation energies and (hyper)polarizability calculations of large molecules. Application of parallelization and linear scaling techniques to time-dependent density functional response theory

✍ S. J. A. van Gisbergen; C. Fonseca Guerra; E. J. Baerends 📂 Article 📅 2000 🏛 John Wiley and Sons 🌐 English ⚖ 241 KB 👁 2 views

We document recent improvements in the efficiency of our implementation in the Amsterdam Density Functional program (ADF) of the response equations in time-dependent density functional theory (TDDFT). Applications to quasi one-dimensional polyene chains and to three-dimensional water clusters show t

Wavelet-based linear-response time-depen

Wavelet-based linear-response time-dependent density-functional theory

✍ Bhaarathi Natarajan; Luigi Genovese; Mark E. Casida; Thierry Deutsch; Olga N. Bu 📂 Article 📅 2012 🏛 Elsevier Science 🌐 English ⚖ 538 KB

TIME-DEPENDENT DENSITY FUNCTIONAL THEORY

✍ Marques, M.A.L.; Gross, E.K.U. 📂 Article 📅 2004 🏛 Annual Reviews 🌐 English ⚖ 403 KB

Time-dependent density-functional theory

📂 Article 📅 2009 🏛 Royal Society of Chemistry 🌐 English ⚖ 310 KB

Linear-response time-dependent density-f

Linear-response time-dependent density-functional theory with pairing fields

✍ Peng, Degao; van Aggelen, Helen; Yang, Yang; Yang, Weitao 📂 Article 📅 2014 🏛 American Institute of Physics 🌐 English ⚖ 415 KB

Propagator corrections to adiabatic time

Propagator corrections to adiabatic time-dependent density-functional theory linear response theory

✍ Casida, Mark E. 📂 Article 📅 2005 🏛 American Institute of Physics 🌐 English ⚖ 402 KB