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Multiscale computational modeling of phytochemicals for iron corrosion inhibition: Bridging DFT, SCC-DFTB, and molecular dynamics for eco-friendly solutions

  • Nuha Wazzan*
  • , I. B. Obot
  • , Hassane Lgaz
  • , Zaki Safi
  • , Ohoud Al-Qurashi
  • *Corresponding author for this work

Research output: Contribution to journalArticlepeer-review

44 Scopus citations

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