Atomic Velocity Projection Method: A New Analysis Method for Vibrational Spectra in Terms of Internal Coordinates for a Better Understanding of Zeolite Nanogrowth-Reference-Cited by-同舟云学术

Atomic Velocity Projection Method: A New Analysis Method for Vibrational Spectra in Terms of Internal Coordinates for a Better Understanding of Zeolite Nanogrowth

Published:2011-03-03 Issue:4 Volume:7 Page:1045-1061
ISSN:1549-9618
Container-title:Journal of Chemical Theory and Computation
language:en
Short-container-title:J. Chem. Theory Comput.

Author:

Van Houteghem Marc¹,Verstraelen Toon¹,Van Neck Dimitri¹,Kirschhock Christine²,A. Martens Johan²,Waroquier Michel¹,Van Speybroeck Veronique¹

Affiliation:

1. Center for Molecular Modeling, QCMM Alliance Ghent-Brussels, Ghent University, Technologiepark 903, B-9052 Zwijnaarde, Belgium

2. Center for Surface Chemistry and Catalysis, Leuven University, Kasteelpark Arenberg 23, B-3001 Heverlee, Belgium

Publisher

American Chemical Society (ACS)

Subject

Physical and Theoretical Chemistry,Computer Science Applications

Link

https://pubs.acs.org/doi/pdf/10.1021/ct100538c

Reference61 articles.

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3. Structure and Dynamics of Zeolites Investigated by Molecular Dynamics

4. Hedlund, J.; Schoeman, B.; Sterte, J.Progress in Zeolites and Microporous Materials;Chon, H.; Ihm, S.K.; Uh, Y. S., Eds.Elsevier:Amsterdam, The Netherlands, 1997; pp2203−2210.

5. Physicochemical Characterization of Silicalite-1 Nanophase Material

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