Lattice vibrational calculation of A-type zeolite using the pseudolattice method

Kyoung Tai No; Dong Han Bae; Mu Shik Jhon

doi:10.1021/j100400a009

Lattice vibrational calculation of A-type zeolite using the pseudolattice method

Kyoung Tai No, Dong Han Bae, Mu Shik Jhon

Research output: Contribution to journal › Article › peer-review

36 Citations (Scopus)

Abstract

The lattice vibrational calculation of A-type zeolite was performed with the pseudolattice (PL) method. The vibrational spectra obtained from experiments were assigned by using calculated vibrational frequencies and modes. The internal and external modes were redefined from their dynamical vectors and the slope of frequencies vs. Al/(Si + Al) ratio. Most of the calculated frequencies and normal modes are in good agreement with the observed vibrational spectra in the region of 1200-250 cm^-1.

Original language	English
Pages (from-to)	1772-1780
Number of pages	9
Journal	Journal of physical chemistry
Volume	90
Issue number	9
DOIs	https://doi.org/10.1021/j100400a009
Publication status	Published - 1986

All Science Journal Classification (ASJC) codes

Engineering(all)
Physical and Theoretical Chemistry

Access to Document

10.1021/j100400a009

Cite this

@article{45b937a6b5b8415f901367ee98c6c600,

title = "Lattice vibrational calculation of A-type zeolite using the pseudolattice method",

abstract = "The lattice vibrational calculation of A-type zeolite was performed with the pseudolattice (PL) method. The vibrational spectra obtained from experiments were assigned by using calculated vibrational frequencies and modes. The internal and external modes were redefined from their dynamical vectors and the slope of frequencies vs. Al/(Si + Al) ratio. Most of the calculated frequencies and normal modes are in good agreement with the observed vibrational spectra in the region of 1200-250 cm-1.",

author = "No, {Kyoung Tai} and Bae, {Dong Han} and Jhon, {Mu Shik}",

year = "1986",

doi = "10.1021/j100400a009",

language = "English",

volume = "90",

pages = "1772--1780",

journal = "Journal of physical chemistry",

issn = "0022-3654",

publisher = "American Chemical Society",

number = "9",

}

TY - JOUR

T1 - Lattice vibrational calculation of A-type zeolite using the pseudolattice method

AU - No, Kyoung Tai

AU - Bae, Dong Han

AU - Jhon, Mu Shik

PY - 1986

Y1 - 1986

N2 - The lattice vibrational calculation of A-type zeolite was performed with the pseudolattice (PL) method. The vibrational spectra obtained from experiments were assigned by using calculated vibrational frequencies and modes. The internal and external modes were redefined from their dynamical vectors and the slope of frequencies vs. Al/(Si + Al) ratio. Most of the calculated frequencies and normal modes are in good agreement with the observed vibrational spectra in the region of 1200-250 cm-1.

AB - The lattice vibrational calculation of A-type zeolite was performed with the pseudolattice (PL) method. The vibrational spectra obtained from experiments were assigned by using calculated vibrational frequencies and modes. The internal and external modes were redefined from their dynamical vectors and the slope of frequencies vs. Al/(Si + Al) ratio. Most of the calculated frequencies and normal modes are in good agreement with the observed vibrational spectra in the region of 1200-250 cm-1.

UR - http://www.scopus.com/inward/record.url?scp=33845373672&partnerID=8YFLogxK

UR - http://www.scopus.com/inward/citedby.url?scp=33845373672&partnerID=8YFLogxK

U2 - 10.1021/j100400a009

DO - 10.1021/j100400a009

M3 - Article

AN - SCOPUS:33845373672

SN - 0022-3654

VL - 90

SP - 1772

EP - 1780

JO - Journal of physical chemistry

JF - Journal of physical chemistry

IS - 9

ER -

Lattice vibrational calculation of A-type zeolite using the pseudolattice method

Abstract

All Science Journal Classification (ASJC) codes

Access to Document

Other files and links

Fingerprint

Cite this