Molecular interactions in nanocellulose assembly

Alternative hydrogen bond models of cellulose II and IIII based on molecular force-fields and density functional theory

(2015) Pan Chen et al.   CELLULOSE

Anisotropy of the elastic properties of crystalline cellulose Iβ from first principles density functional theory with Van der Waals interactions

(2013) Fernando L. Dri et al.   CELLULOSE

Levoglucosan: A Calorimetric, Thermodynamic, Spectroscopic, and Computational Investigation

(2013) Inês M. Rocha et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

Looking at hydrogen bonds in cellulose

(2010) Yoshiharu Nishiyama et al.   ACTA CRYSTALLOGRAPHICA SECTION D-BIOLOGICAL CRYSTALLOGRAPHY

Estimating the Hydrogen Bond Energy

(2010) Katharina Wendler et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Improved Description of the Structure of Molecular and Layered Crystals: Ab Initio DFT Calculations with van der Waals Corrections

(2010) Tomáš Bučko et al.   JOURNAL OF PHYSICAL CHEMISTRY A