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Hydrogen dissociation on diene-functionalized carbon nanotubesJavad Beheshtian, Ali Ahmadi Peyghan, Zargham Bagheri · 2013
Carbon nanocone as an ammonia sensor: DFT studiesMohammad T. Baei, Ali Ahmadi Peyghan, Zargham Bagheri · 2013
Functionalization of [60] fullerene with butadienes: A DFT studyJavad Beheshtian; Ali Ahmadi Peyghan; Zargham Bagheri · 2012
Theoretical investigation of C60 fullerene functionalization with tetrazineJavad Beheshtian; Ali Ahmadi Peyghan; Zargham Bagheri · 2012
Covalent functionalization of AlN nanotubes with acetyleneBaei, Mohammad T.; Ahmadi Peyghan, Ali; Bagheri, Zargham · Physica E: Low-dimensional Systems and Nanostructures · 2013
Quantum chemical study of fluorinated AlN nano-cageJavad Beheshtian; Ali Ahmadi Peyghan; Zargham Bagheri · 2012
Carbon nanotube functionalization with carboxylic derivatives: a DFT studyJavad Beheshtian, Ali Ahmadi Peyghan, Zargham Bagheri · 2013
Transition metal atom adsorptions on a boron nitride nanocageMohammad T. Baei, Zargham Bagheri, Ali Ahmadi Peyghan · 2013
VARIATIONAL ELECTROSTATICS FOR CHARGE SOLVATIONWANG, ZHEN-GANG · Journal of Theoretical and Computational Chemistry · 2008
Clusters: From dimers to nanoparticlesSpringborg, Michael; Thakkar, Ajit J. · Computational and Theoretical Chemistry · 2013
Theoretical studies on aminoborane oligomersBheema Lingam, Ch.; Tewari, Surya P. · Computational and Theoretical Chemistry · 2013
On tautomerism of diazinonesGraff, Marek; Dobrowolski, Jan Cz. · Computational and Theoretical Chemistry · 2013
Editorial BoardComputational and Theoretical Chemistry · 2014
Editorial BoardComputational and Theoretical Chemistry · 2013
Editorial noteThakkar, Ajit J.; Yáñez, Manuel · Computational and Theoretical Chemistry · 2014