Prediction of pressure dependent rate constant for the reaction, SiH4(g)→SiH3(g)+H(g), using RRKM theory aided by ab-initio MO

Nagahiro Saito, Mitsuhito Hirota, Takahiro Ishizaki, Akio Fuwa

Research output: Contribution to journalArticle

1 Citation (Scopus)

Abstract

The pressure dependent rate constant for the reaction, SiH4(g)→SiH3(g)+H was predicted using the Rice-Ramspger-Kassel-Marcus theory aided by Ab-initio molecular orbital (MO). It was calculated under conditions in which the temperatures were from 600 to 1500 K intervals of 100 K. The Arrhenius type rate expression was shown.

Original languageEnglish
Pages (from-to)520-526
Number of pages7
JournalNippon Kinzoku Gakkaishi/Journal of the Japan Institute of Metals
Volume63
Issue number4
Publication statusPublished - 1999
Externally publishedYes

Fingerprint

Molecular orbitals
Rate constants
molecular orbitals
rice
predictions
intervals
Temperature
temperature

ASJC Scopus subject areas

  • Metals and Alloys

Cite this

@article{c5346296cb6e4451bfad56faa6b9c3bb,
title = "Prediction of pressure dependent rate constant for the reaction, SiH4(g)→SiH3(g)+H(g), using RRKM theory aided by ab-initio MO",
abstract = "The pressure dependent rate constant for the reaction, SiH4(g)→SiH3(g)+H was predicted using the Rice-Ramspger-Kassel-Marcus theory aided by Ab-initio molecular orbital (MO). It was calculated under conditions in which the temperatures were from 600 to 1500 K intervals of 100 K. The Arrhenius type rate expression was shown.",
author = "Nagahiro Saito and Mitsuhito Hirota and Takahiro Ishizaki and Akio Fuwa",
year = "1999",
language = "English",
volume = "63",
pages = "520--526",
journal = "Nippon Kinzoku Gakkaishi/Journal of the Japan Institute of Metals",
issn = "0021-4876",
publisher = "Japan Institute of Metals (JIM)",
number = "4",

}

TY - JOUR

T1 - Prediction of pressure dependent rate constant for the reaction, SiH4(g)→SiH3(g)+H(g), using RRKM theory aided by ab-initio MO

AU - Saito, Nagahiro

AU - Hirota, Mitsuhito

AU - Ishizaki, Takahiro

AU - Fuwa, Akio

PY - 1999

Y1 - 1999

N2 - The pressure dependent rate constant for the reaction, SiH4(g)→SiH3(g)+H was predicted using the Rice-Ramspger-Kassel-Marcus theory aided by Ab-initio molecular orbital (MO). It was calculated under conditions in which the temperatures were from 600 to 1500 K intervals of 100 K. The Arrhenius type rate expression was shown.

AB - The pressure dependent rate constant for the reaction, SiH4(g)→SiH3(g)+H was predicted using the Rice-Ramspger-Kassel-Marcus theory aided by Ab-initio molecular orbital (MO). It was calculated under conditions in which the temperatures were from 600 to 1500 K intervals of 100 K. The Arrhenius type rate expression was shown.

UR - http://www.scopus.com/inward/record.url?scp=0032690709&partnerID=8YFLogxK

UR - http://www.scopus.com/inward/citedby.url?scp=0032690709&partnerID=8YFLogxK

M3 - Article

VL - 63

SP - 520

EP - 526

JO - Nippon Kinzoku Gakkaishi/Journal of the Japan Institute of Metals

JF - Nippon Kinzoku Gakkaishi/Journal of the Japan Institute of Metals

SN - 0021-4876

IS - 4

ER -