✦ LIBER ✦

Free energy and entropy of diffusion by ab initio molecular dynamics: Alkali ions in silicon

✍ Scribed by Milman, V.; Payne, M. C.; Heine, V.; Needs, R. J.; Lin, J. S.; Lee, M. H.

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Intercalation and diffusion of lithium i

✍ Song, Bo; Yang, Junwei; Zhao, Jijun; Fang, Haiping 📂 Article 📅 2011 🏛 Royal Society of Chemistry 🌐 English ⚖ 311 KB

Calculation of Free Energy Profiles for

✍ Kelly, Evan; Seth, Michael; Ziegler, Tom 📂 Article 📅 2004 🏛 American Chemical Society 🌐 English ⚖ 357 KB

Molecular dynamics study of formamidine

✍ S. Tolosa Arroyo; A. Hidalgo Garcia; J. A. Sansón Martín 📂 Article 📅 2010 🏛 Springer 🌐 English ⚖ 475 KB

Calculation of free-energy curves for th

✍ S. Tolosa Arroyo; A. Hidalgo Garcia; J.A. Sansón Martín 📂 Article 📅 2008 🏛 Elsevier Science 🌐 English ⚖ 242 KB

Potential energy and free energy surface

✍ Chocholoušová, Jana; Vacek, Jaroslav; Hobza, Pavel 📂 Article 📅 2002 🏛 Royal Society of Chemistry 🌐 English ⚖ 142 KB