Authors | Title | Journal | Volume | Number | Pages | Date |
Asadollah Boshra, Majid Monajjemi, Mehran Aghaie, Hossein Aghaie | Density Functional Theory Investigation of Natural Bond Orbital Population Analysis and Gauge-Includ | Journal of Computational and Theoretical Nanoscience | 7 | | 1-12 | 2010 |
Ahmad Seif, Mahmoud Mirzaei, Mehran Aghaie, Asadollah Boshra | AlN Nanotubes: A DFT Study of Al-27 and N-14 Electric Field Gradient Tensors | Z. Naturforsch | 62a | | 711-715 | 2007 |
Goudarz Mohseni Rouzbehani, Asadollah Boshra,
Ahmad Seif
| B24N24 nanocages: a GIAO density functional theory study of 14N and 11B nuclear magnetic shielding a | Monatsh Chem | 140 | | 255-263 | 2009 |
Ahmad RezaOliaey, AsadollahBoshra, MahyarKhavary | Spin polarized bonding analysis of endohedral boron nitride nanocages: Density functional theory stu | Physica E | 42 | | 2314-2318 | 2010 |
Asadollah Boshra,
Ahmad Seif
| A boroxol ring doped zigzag boron nitride nanotube: a computational DFT study of the quadrupole coup | Canadian Journal of Physics | 87 | | 647-652 | 2009 |
Ahmad Seif , Asadollah Boshra | Influence of Boroxol ring doping on the N-15 and B-11 NMR parameters in zigzag boron nitride nanotub | Journal of Molecular Structure: THEOCHEM | 895 | | 96-99 | 2009 |
Nima Karachi • Asadollah Boshra • Siamak Jadidi | DFT based insights into reactivity descriptors of encapsulated B24N24 nanocages | Structural Chemistry | 22 | | 805-809 | 2011 |
Asadollah Boshra • Siamak Jadidi •
Maryam Goudarzi • Samaneh Niroumand •
Maryam Mohammadi
| DFT Study of Endohedral Atoms Effect on Electrophilicity of B16N16 Boron Nitride Nanocage: Comparati | J of Cluster Science | 23 | | 297-310 | 2011 |
Asadollah Boshraa, Siamak Jadidi, Ahmad reza Oliaey, Majid Monajjemi, Mehran Aghaie | DFT study of nuclear magnetic shielding, electric field gradient tensors and electrophilicity indice | Journal of Nanostructure in Chemistry | 2 | | 98-109 | 2011 |
Asadollah Boshra, Samira Bagheri, Siamak Jadidi | Global Reactivity of Heterostructure Armchair BC2N-(4,4) Nanotubes: A Density Functional Theory Inve | Heteroatom Chemistry | 3 | | 168-173 | 2013 |
H. Ghanadzadeh a, A. Ghanadzadeh, R. Sariri , A. Boshra | Isobaric vapor–liquid phase equilibria for the binary systems of tert-butanol + 2-ethyl-1-hexanol an | Fluid Phase Equilibria | 233 | | 123-128 | 2005 |
Ahmad Seif and Asadollah Boshra
| Single-Wall GaN Nanotubes: A Density Functional Theory Study of Ga-69 and N-14 Quadrupole Coupling | Journal of Computational and Theoretical Nanoscience | 6 | | 732-736 | 2009 |
Ahmad Seif, Asadollah Boshra, Majid Seif | Lithium-doped (4,4) Boron nitride nanotube: Density functional theory study of N and B nuclear magne | Journal of Molecular Structure: THEOCHEM | 895 | | 82-85 | 2009 |
Ehsan Zahedi, Ali Bodaghi, Ahmad Seif, Asadollah Boshra | The influence of NH3-attaching on the NMR parameters in the zigzag BN nanotube | Superlattices and Microstructures | 49 | | 169-175 | 2011 |
Asadollah Boshra, Mohammad Mehdi Dehshiri, Ahmad Seif, Reza Jafari | Effect of nanotube length on the aromaticity and CSI parameters of finite length single-wall zigzag | Journal of Molecular Structure: THEOCHEM | 906 | | 63-67 | 2009 |
M. Farahani, A. Seif and A. Boshra | Den sity Func tional Study of 27Al and 14N Quadrupole Cou pling Con stants in the Car bon Doped (4,4 | Polish Journal of Chemistry | 83 | | 45-151 | 2009 |
Ahmad Seif and Asadollah Boshra | Single-Wall GaN Nanotubes: A Density Functional Theory Study of Ga-69 and N-14 Quadrupole Coupling C | Journal of Computational and Theoretical Nanoscience | 6 | | 1-5 | 2009 |
Masoud Darvish Ganji, A. Boshra, and A. Bakhshandeh | Spin Polarization of Electrons in Metallohedral B24N24 Nanocage: A Density Functional Theory Investi | Journal of Computational and Theoretical Nanoscience | 10 | | 1-6 | 2013 |
Ahmad Seif, Asadollah Boshra, and Ali Bodaghi | The Fluorinated(10, 0) Boron Nitride Nanotube: A Computational Nuclear Magnetic Resonance and Nuclea | Journal of Nanoscience and Nanotechnology | 9 | | 1-5 | 2009 |