✦ LIBER ✦

A Transferable H-Bonding Correction for Semiempirical Quantum-Chemical Methods

✍ Scribed by Korth, Martin; Pitoňák, Michal; Řezáč, Jan; Hobza, Pavel

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Advanced Corrections of Hydrogen Bonding

✍ Řezáč, Jan; Hobza, Pavel 📂 Article 📅 2011 🏛 American Chemical Society 🌐 English ⚖ 985 KB

Basic ideas for the correction of semiem

✍ M.I. Bernal-Uruchurtu; M.F. Ruiz-López 📂 Article 📅 2000 🏛 Elsevier Science 🌐 English ⚖ 234 KB

Semiempirical Quantum Chemical PM6 Metho

✍ Řezáč, Jan; Fanfrlík, Jindřich; Salahub, Dennis; Hobza, Pavel 📂 Article 📅 2009 🏛 American Chemical Society 🌐 English ⚖ 229 KB

Quantum chemical evidence for C?H ? C hy

✍ Platts, James A.; Howard, Sean T.; Wo?niak, Krzysztof 📂 Article 📅 1996 🏛 Royal Society of Chemistry 🌐 English ⚖ 347 KB

Coupled calculation of vibrational frequ

✍ H.-J. Köhler; J. Fruwert; A. Jenichen 📂 Article 📅 1984 🏛 Elsevier Science 🌐 English ⚖ 454 KB

On the reliability of the corrected semi

✍ Pecina, Adam; Přenosil, Ondřej; Fanfrlík, Jindřich; Řezáč, Jan; Granatier, Jaros 📂 Article 📅 2011 🏛 UOCHB 🌐 English ⚖ 667 KB