Quantum Adsorbates: Path Integral Monte Carlo Simulations of Helium in Silicalite
Author:
Affiliation:
1. Department of Chemistry, Indian Institute of Technology-Delhi, Hauz Khas, New Delhi 110016, India
Publisher
American Chemical Society (ACS)
Subject
Materials Chemistry,Surfaces, Coatings and Films,Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/jp962155s
Reference39 articles.
1. Dynamics of adsorbates in micropores of zeolites and breakdown of Arrhenius behavior
2. Simulation studies of the structure and energetics of sorbed molecules in high-silica zeolites. 1. Hydrocarbons
3. Molecular dynamics study of methane and xenon in silicalite
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