Free energy landscapes for the thermodynamic understanding of adsorption-induced deformations and structural transitions in porous materials.

The Journal of chemical physics

Volumn 137, Issue 4, 2012, Pages 044118-

  Bousquet, D ^a   Coudert, F X ^b   Boutin, A ^b  

^a ECOLE NORMALE SUPÉRIEURE   (France)

^b NONE

Author keywords

[No Author keywords available]

Indexed keywords

ALUMINUM; ORGANOMETALLIC COMPOUND;

ADSORPTION; ALGORITHM; ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; MOLECULAR DYNAMICS; MONTE CARLO METHOD; POROSITY; SURFACE PROPERTY; THERMODYNAMICS;

ADSORPTION; ALGORITHMS; ALUMINUM; MOLECULAR DYNAMICS SIMULATION; MOLECULAR STRUCTURE; MONTE CARLO METHOD; ORGANOMETALLIC COMPOUNDS; POROSITY; SURFACE PROPERTIES; THERMODYNAMICS;

EID: 84871686442     PISSN: None     EISSN: 10897690     Source Type: Journal    
DOI: 10.1063/1.4738776     Document Type: Article

References (0)