List of Articles DFT

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  1 - DFT studies of all fluorothiophenes and their radical cations as candidate monomers for conductive polymers
  Saeed Jameh-Bozorghi Hossein Shirani
• Open Access Article
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  2 - Change of the tautomeric preference for radical cation of pyruvic acid. DFT studies in the gas phase
  Ewa Daniela Raczyńska Malgorzta Hallmann Kinga Duczmal
• Open Access Article
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  3 - Computational study on geometric and electronic properties of 3.6-carbazole based conjugated polymers
  Mohammed Bouachrine Kenza Hasnaoui Abdellatif Makayssi Mohammed Hamidi
• Open Access Article
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  4 - Neighboring group’s effect in sigmatropic migration on indol rings. A theoretical study and NBO analysis
  Saeed Jameh-Bozorghi Zahra Javanshir Fatemeh Naseri Maryam Darvishpoor
• Open Access Article
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  5 - Tautomeric equilibria for ionized oxamic acid - inhibitor of LDH
  Ewa D. Raczyńska Małgorzata Hallmann Kinga Duczmal