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نمایش تعداد 1-10 از 45

Quantum mechanical investigation on the hydroxycarbonylation of styrene using a palladium complex catalyst

نوع: Journal Paper

نویسنده : Morteza Elahi; S. Ali Beyramabadi; Ali Morsali

سال: 2016

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New Fe(III) complex with 8-(4-chlorophenyl)-3-butyl-3H-imidazo[4′,5′:3,4]benzo[1,2-c]isoxazol-5-amine (5-AIBI) ligand: Synthesis, spectroscopic characterization and DFT calculations

نوع: Journal Paper

نویسنده : Zahra Agheli; Mehdi Pordel; S. Ali Beyramabadi

سال: 2017

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A DFT investigation of structure, spectroscopic properties and tautomerism of the anticonvulsant drug Lyrica

نوع: Journal Paper

نویسنده : Zohre Sadeghzade; S. Ali Beyramabadi; Ali Morsali

سال: 2014

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Quantum Mechanical Study on the Mechanistic, Energetic, and Structural Properties of Adsorption of 6-Thioguanine onto γ-Fe2nO3n Nanoparticles

نوع: Journal Paper

نویسنده : Monir Teymoori; Ali Morsali; Mohammad Reza Bozorgmehr; S. Ali Beyramabadi

سال: 2017

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Mechanistic, energetic and structural studies of carbon nanotubes functionalised with dihydroartemisinin drug in gas and solution phases

نوع: Journal Paper

نویسنده : Sahar Naderi; Ali Morsali; Mohammad Reza Bozorgmehr; S. Ali Beyramabadi

سال: 2017

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Three VO 2+ complexes of the pyridoxal-derived Schiff bases: Synthesis, experimental and theoretical characterizations, and catalytic activity in a cyclocondensation reaction

نوع: Journal Paper

نویسنده : Maryam Jafari-Moghaddam; S. Ali Beyramabadi; Maryam Khashi; Ali Morsali

سال: 2017

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Theoretical investigation on the kinetics and mechanism of the synthesis of fluorescent 3,8-disubstituted-3H-imidazo[4,5-a]acridine-11-carbonitriles

نوع: Journal Paper

نویسنده : Fatemeh Zonozi; Mehdi Pordel; S. Ali Beyramabadi; Ali Morsali

سال: 2016

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THE HEAT CAPACITIES FROM ANALYTICAL DISTRIBUTION FUNCTIONS

نوع: Journal Paper

نویسنده : JALAL S. EMAMPOUR; ALI MORSALI; S. ALI BEYRAMABADI

سال: 2009

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Evaluation of P–V–T differential properties of the Lennard-Jones fluid using radial distribution functions and molecular dynamics

نوع: Journal Paper

نویسنده : Ali Morsali; S. Ali Beyramabadi; M. Reza Bozorgmehr

ناشر: Elsevier Science

سال: 2007

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Quantum mechanical study on the mechanism and kinetics of the hydrolysis of organopalladium Complex [Pd(CNN)P(OMe)3]+ in low acidity range

نوع: Journal Paper

نویسنده : S. Hooman Vahidi; Ali Morsali; S. Ali Beyramabadi

سال: 2012

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Quantum mechanical investigation on the hydroxycarbonylation of styrene using a palladium complex catalyst

New Fe(III) complex with 8-(4-chlorophenyl)-3-butyl-3H-imidazo[4′,5′:3,4]benzo[1,2-c]isoxazol-5-amine (5-AIBI) ligand: Synthesis, spectroscopic characterization and DFT calculations

A DFT investigation of structure, spectroscopic properties and tautomerism of the anticonvulsant drug Lyrica

Quantum Mechanical Study on the Mechanistic, Energetic, and Structural Properties of Adsorption of 6-Thioguanine onto γ-Fe2nO3n Nanoparticles

Mechanistic, energetic and structural studies of carbon nanotubes functionalised with dihydroartemisinin drug in gas and solution phases

Three VO 2+ complexes of the pyridoxal-derived Schiff bases: Synthesis, experimental and theoretical characterizations, and catalytic activity in a cyclocondensation reaction

Theoretical investigation on the kinetics and mechanism of the synthesis of fluorescent 3,8-disubstituted-3H-imidazo[4,5-a]acridine-11-carbonitriles

THE HEAT CAPACITIES FROM ANALYTICAL DISTRIBUTION FUNCTIONS

Evaluation of P–V–T differential properties of the Lennard-Jones fluid using radial distribution functions and molecular dynamics

Quantum mechanical study on the mechanism and kinetics of the hydrolysis of organopalladium Complex [Pd(CNN)P(OMe)3]+ in low acidity range

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Quantum mechanical investigation on the hydroxycarbonylation of styrene using a palladium complex catalyst

New Fe(III) complex with 8-(4-chlorophenyl)-3-butyl-3H-imidazo[4′,5′:3,4]benzo[1,2-c]isoxazol-5-amine (5-AIBI) ligand: Synthesis, spectroscopic characterization and DFT calculations

A DFT investigation of structure, spectroscopic properties and tautomerism of the anticonvulsant drug Lyrica

Quantum Mechanical Study on the Mechanistic, Energetic, and Structural Properties of Adsorption of 6-Thioguanine onto γ-Fe2nO3n Nanoparticles

Mechanistic, energetic and structural studies of carbon nanotubes functionalised with dihydroartemisinin drug in gas and solution phases

Three VO 2+ complexes of the pyridoxal-derived Schiff bases: Synthesis, experimental and theoretical characterizations, and catalytic activity in a cyclocondensation reaction

Theoretical investigation on the kinetics and mechanism of the synthesis of fluorescent 3,8-disubstituted-3H-imidazo[4,5-a]acridine-11-carbonitriles

THE HEAT CAPACITIES FROM ANALYTICAL DISTRIBUTION FUNCTIONS

Evaluation of P–V–T differential properties of the Lennard-Jones fluid using radial distribution functions and molecular dynamics

Quantum mechanical study on the mechanism and kinetics of the hydrolysis of organopalladium Complex [Pd(CNN)P(OMe)3]+ in low acidity range