✦ LIBER ✦

Hydrogen-bonding interactions in acetic acid monohydrates and dihydrates by density-functional theory calculations

✍ Scribed by Gao, Q.; Leung, K. T.

Book ID: 120163748
Publisher: American Institute of Physics
Year: 2005
Tongue: English
Weight: 608 KB
Volume: 123
Category: Article
ISSN: 0021-9606
DOI: 10.1063/1.2006089

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Hydrogen bonding in amylose/DMSO complex

Hydrogen bonding in amylose/DMSO complexes studied by vibrational spectroscopy and density functional theory calculations

✍ Alberto Milani; Nur Aiman Fadel; Luigi Brambilla; Mirella Del Zoppo; Chiara Cast 📂 Article 📅 2009 🏛 John Wiley and Sons 🌐 English ⚖ 369 KB

Hydrogen bonding and stacking interactio

Hydrogen bonding and stacking interactions of nucleic acid base pairs: A density-functional-theory based treatment

✍ Elstner, Marcus; Hobza, Pavel; Frauenheim, Thomas; Suhai, Sándor; Kaxiras, Efth 📂 Article 📅 2001 🏛 American Institute of Physics 🌐 English ⚖ 270 KB

Hydrogen-bonded acetic acid dimers: Anha

Hydrogen-bonded acetic acid dimers: Anharmonic coupling and linear infrared spectra studied with density-functional theory

✍ Dreyer, Jens 📂 Article 📅 2005 🏛 American Institute of Physics 🌐 English ⚖ 844 KB

A calculating proof on hydrogen bonding

A calculating proof on hydrogen bonding in ordinary ice by the first-principles density functional theory

✍ Zhang, Peng; Han, Sheng-Hao; Yu, Hui; Liu, Yang 📂 Article 📅 2013 🏛 The Royal Society of Chemistry 🌐 English ⚖ 509 KB

Density functional theory and topologica

Density functional theory and topological analysis on the hydrogen bonding interactions in N-protonated adrenaline–DMSO complexes

✍ Zhengguo Huang; Yumei Dai; Lei Yu 📂 Article 📅 2010 🏛 Springer 🌐 English ⚖ 380 KB

Amide I Bands of Terminally Blocked Alan

Amide I Bands of Terminally Blocked Alanine in Solutions Investigated by Infrared Spectroscopy and Density Functional Theory Calculation: Hydrogen-Bonding Interactions and Solvent Effects

✍ Lee, Maeng-Eun; Lee, So Yeong; Joo, Sang-Woo; Cho, Kwang-Hwi 📂 Article 📅 2009 🏛 American Chemical Society 🌐 English ⚖ 429 KB