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pro vyhledávání: '"Yathish Kurapati"'
Publikováno v:
Metals, Vol 8, Iss 2, p 81 (2018)
The computational modeling of corrosion inhibitors at the level of molecular interactions has been pursued for decades, and recent developments are allowing increasingly realistic models to be developed for inhibitor–inhibitor, inhibitor–solvent
Externí odkaz:
https://doaj.org/article/928d1f8695094ecd8ea084fbdf7b8ee3
Publikováno v:
CORROSION. 75:90-105
Some recent efforts toward studying adsorption, aggregation, and self-assembly of corrosion inhibitor molecules near metal/water interfaces via classical molecular simulations are reported. Two dif...
Autor:
Yathish Kurapati, Sumit Sharma
Publikováno v:
The journal of physical chemistry. B. 122(22)
We report adsorption behavior of imidazolinium-type surfactant molecules in different aggregation states on metal–water interfaces studied using all-atom molecular dynamics simulations. Surfactant molecules with two different alkyl tail lengths, a
Publikováno v:
Metals, Vol 8, Iss 2, p 81 (2018)
Metals; Volume 8; Issue 2; Pages: 81
Metals; Volume 8; Issue 2; Pages: 81
The computational modeling of corrosion inhibitors at the level of molecular interactions has been pursued for decades, and recent developments are allowing increasingly realistic models to be developed for inhibitor–inhibitor, inhibitor–solvent