Application of Density Functional Theory to Study the Anticorrosive Effects of Some Pyrazole Derivatives

field_of_study

Blank

university

Al-Azhar University – Gaza

authors

Safi Z.S.; Rida M.H.; Tamous H.M.

authors_full_names

Safi, Zaki S. (16199979600); Rida, Mohammed H. (59010290500); Tamous, Hassan M. (8291321000)

authors_id

16199979600; 59010290500; 8291321000

year

2023

source_title

Corrosion Science: Theoretical and Practical Applications

article_title

Application of Density Functional Theory to Study the Anticorrosive Effects of Some Pyrazole Derivatives

page_start

107

page_end

136

publisher

Apple Academic Press

affiliations

Chemistry Department, Faculty of Science, Al Azhar University-Gaza, Gaza City, Palestine

authors_with_affiliations

Safi Z.S., Chemistry Department, Faculty of Science, Al Azhar University-Gaza, Gaza City, Palestine; Rida M.H., Chemistry Department, Faculty of Science, Al Azhar University-Gaza, Gaza City, Palestine; Tamous H.M., Chemistry Department, Faculty of Science, Al Azhar University-Gaza, Gaza City, Palestine

cited_by

1

doi

10.1201/9781003328513-4

author_keywords

4-phenylazopyrazolo-3,5-diamine; corrosion inhibition; density functional theory (DFT); global molecular descriptors; local fukui indices