List of Articles Theoretical

• Open Access Article
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  1 - DFT Study of 1H-tetrazolyl derivatives of tetrahedrane
  Mehdi Nabati Mehrdad Mahkam
• Open Access Article
  • Abstract Page
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  2 - Theoretical study of tetrahedrane derivatives
  Mehdi Nabati Mehrdad Mahkam Yaser Gholizade Atani
• Open Access Article
  • Abstract Page
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  3 - Theoretical study of molecular mechanics methods on clonidine drug-carbon nano cone
  Zohreh Yousefian Karim Zare
• Open Access Article
  • Abstract Page
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  4 - A Theoretical Study on Dopamine: Geometry, energies and NMR
  Maryam Mehdizadeh Barforushi Karim Zare
• Open Access Article
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  5 - A theoretical study on methamphetamine: geometry, energies, NMR and NBO
  Jamileh Shakibayifar Karim Zare
• Open Access Article
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  6 - Density functional theory study of the structural properties of cis-trans isomers of bis-(5-nitro-2H-tetrazolato-N2) tetraammine cobalt (III) perchlorate (BNCP)
  Mehdi Nabati
• Open Access Article
  • Abstract Page
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  7 - Derivation of ionization energy and electron affinity equations using chemical hardness and absolute electronegativity in isoelectronic series
  S. Kaya C. Kaya