Understanding inhibition of steel corrosion by some potent triazole derivatives of pyrimidine through density functional theory and molecular dynamics simulation …

A Bello, A Uzairu, GA Shallangwa - Journal of the Turkish Chemical Society … - dergipark.org.tr
Density Functional Theory (DFT) calculation at B3LYP level of theory and 6-31G* basis set
was applied on some triazole derivatives of pyrimidine which led to the optimization of their …

[PDF][PDF] Understanding Inhibition of Steel Corrosion by Some Potent Triazole Derivatives of Pyrimidine through Density Functional Theory and Molecular Dynamics …

BA Umar, A Uzairu, GA Shallangwa - pdfs.semanticscholar.org
Density Functional Theory (DFT) calculation at B3LYP level of theory and 6-31G* basis set
was applied on some triazole derivatives of pyrimidine which led to the optimization of their …

[PDF][PDF] Understanding Inhibition of Steel Corrosion by Some Potent Triazole Derivatives of Pyrimidine through Density Functional Theory and Molecular Dynamics …

BA Umar, A Uzairu, GA Shallangwa - researchgate.net
Density Functional Theory (DFT) calculation at B3LYP level of theory and 6-31G* basis set
was applied on some triazole derivatives of pyrimidine which led to the optimization of their …

[PDF][PDF] Understanding Inhibition of Steel Corrosion by Some Potent Triazole Derivatives of Pyrimidine through Density Functional Theory and Molecular Dynamics …

BA Umar, A Uzairu, GA Shallangwa - academia.edu
Density Functional Theory (DFT) calculation at B3LYP level of theory and 6-31G* basis set
was applied on some triazole derivatives of pyrimidine which led to the optimization of their …

Understanding Inhibition of Steel Corrosion by Some Potent Triazole Derivatives of Pyrimidine through Density Functional Theory and Molecular Dynamics Simulation …

A Bello, A Uzairu, GA Shallangwa - Journal of the Turkish Chemical Society … - dergipark.org.tr
Density Functional Theory (DFT) calculation at B3LYP level of theory and 6-31G* basis set
was applied on some triazole derivatives of pyrimidine which led to the optimization of their …

[PDF][PDF] Understanding Inhibition of Steel Corrosion by Some Potent Triazole Derivatives of Pyrimidine through Density Functional Theory and Molecular Dynamics …

BA Umar, A Uzairu, GA Shallangwa - academia.edu
Density Functional Theory (DFT) calculation at B3LYP level of theory and 6-31G* basis set
was applied on some triazole derivatives of pyrimidine which led to the optimization of their …