✦ LIBER ✦

Grid-free DFT implementation of local and gradient-corrected XC functionals

✍ Scribed by Gerd Berghold; Jürg Hutter; Michele Parrinello

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

A grid-free DFT implementation of non-lo

✍ Yu Cheng Zheng; Jan E. Almlöf 📂 Article 📅 1996 🏛 Elsevier Science 🌐 English ⚖ 578 KB

Hyper-generalized-gradient functionals c

✍ Haunschild, Robin; Odashima, Mariana M.; Scuseria, Gustavo E.; Perdew, John P.; 📂 Article 📅 2012 🏛 American Institute of Physics 🌐 English ⚖ 368 KB

Performance of Gradient-Corrected and Hy

✍ Chan, Bun; Gill, Peter M. W.; Radom, Leo 📂 Article 📅 2012 🏛 American Chemical Society 🌐 English ⚖ 227 KB

Local and electronic structure of free N

✍ G. É. Yalovega; V. A. Shmatko; A. V. Soldatov 📂 Article 📅 2010 🏛 SP MAIK Nauka/Interperiodica 🌐 English ⚖ 203 KB

Evaluation of a Combination of Local Hyb

✍ Theilacker, Kolja; Arbuznikov, Alexei V.; Bahmann, Hilke; Kaupp, Martin 📂 Article 📅 2011 🏛 American Chemical Society 🌐 English ⚖ 813 KB

Bonding properties of IIA and IIB dimers

✍ G. Ortiz; P. Ballone 📂 Article 📅 1991 🏛 Springer 🌐 English ⚖ 348 KB