Thermochemistry and Electronic Structure of Small Boron Clusters (Bn, n = 5−13) and Their Anions TB Tai, DJ Grant, MT Nguyen, DA Dixon The Journal of Physical Chemistry A 114 (2), 994-1007, 2010 | 152 | 2010 |
Structure of boron clusters revisited, Bn with n= 14–20 TB Tai, NM Tam, MT Nguyen Chemical Physics Letters 530, 71-76, 2012 | 118 | 2012 |
A stochastic search for the structures of small germanium clusters and their anions: enhanced stability by spherical aromaticity of the Ge10 and Ge122− systems TB Tai, MT Nguyen Journal of chemical Theory and computation 7 (4), 1119-1130, 2011 | 107 | 2011 |
Disk Aromaticity of the Planar and Fluxional Anionic Boron Clusters B20−/2− TB Tai, A Ceulemans, MT Nguyen Chemistry–A European Journal 18 (15), 4510-4512, 2012 | 103 | 2012 |
A disk-aromatic bowl cluster B 30: toward formation of boron buckyballs TB Tai, L Van Duong, HT Pham, DTT Mai, MT Nguyen Chemical Communications 50 (13), 1558-1560, 2014 | 84 | 2014 |
Electronic structure and photoelectron spectra of B n with n= 26–29: an overview of structural characteristics and growth mechanism of boron clusters TB Tai, MT Nguyen Physical Chemistry Chemical Physics 17 (20), 13672-13679, 2015 | 79 | 2015 |
The Boron conundrum: the case of cationic clusters B n + with n = 2–20 TB Tai, NM Tam, MT Nguyen Theoretical Chemistry Accounts 131, 1-15, 2012 | 67 | 2012 |
Particle on a Boron Disk: Ring Currents and Disk Aromaticity in B202– TB Tai, RWA Havenith, JL Teunissen, AR Dok, SD Hallaert, MT Nguyen, ... Inorganic chemistry 52 (18), 10595-10600, 2013 | 61 | 2013 |
π-Conjugated Molecules Containing Naphtho[2,3-b]thiophene and Their Derivatives: Theoretical Design for Organic Semiconductors VTT Huong, HT Nguyen, TB Tai, MT Nguyen The Journal of Physical Chemistry C 117 (19), 10175-10184, 2013 | 57 | 2013 |
The B 32 cluster has the most stable bowl structure with a remarkable heptagonal hole TB Tai, MT Nguyen Chemical Communications 51 (36), 7677-7680, 2015 | 52 | 2015 |
A new chiral boron cluster B 44 containing nonagonal holes TB Tai, MT Nguyen Chemical Communications 52 (8), 1653-1656, 2016 | 51 | 2016 |
Thermochemical properties, electronic structure and bonding of mixed lithium boron clusters (BnLi, n= 1–8) and their anions TB Tai, MT Nguyen Chemical Physics 375 (1), 35-45, 2010 | 50 | 2010 |
Thermochemical Properties and Electronic Structure of Boron Oxides BnOm (n = 5−10, m = 1−2) and Their Anions TB Tai, MT Nguyen, DA Dixon The Journal of Physical Chemistry A 114 (8), 2893-2912, 2010 | 47 | 2010 |
Electronic Structures and Thermochemical Properties of the Small Silicon‐Doped Boron Clusters BnSi (n= 1–7) and Their Anions TB Tai, P Kadłubański, S Roszak, D Majumdar, J Leszczynski, ... ChemPhysChem 12 (16), 2948-2958, 2011 | 45 | 2011 |
Thermochemical Parameters and Growth Mechanism of the Boron-Doped Silicon Clusters, SinBq with n = 1–10 and q = −1, 0, +1 NM Tam, TB Tai, MT Nguyen The Journal of Physical Chemistry C 116 (37), 20086-20098, 2012 | 43 | 2012 |
Enhanced Stability by Three-Dimensional Aromaticity of Endohedrally Doped Clusters X10M0/– with X = Ge, Sn, Pb and M = Cu, Ag, Au TB Tai, MT Nguyen The Journal of Physical Chemistry A 115 (35), 9993-9999, 2011 | 43 | 2011 |
Electronic Structure and Thermochemical Properties of Small Neutral and Cationic Lithium Clusters and Boron-Doped Lithium Clusters: Li n 0/+ and Li n B0/+(n= 1–8) TB Tai, PV Nhat, MT Nguyen, S Li, DA Dixon The Journal of Physical Chemistry A 115 (26), 7673-7686, 2011 | 39 | 2011 |
A three-dimensional aromatic B 6 Li 8 complex as a high capacity hydrogen storage material TB Tai, MT Nguyen Chemical Communications 49 (9), 913-915, 2013 | 38 | 2013 |
Comment on" B38: an all-boron fullerene analogue" by J. Lv, Y. Wang, L. Zhu and Y. Ma, Nanoscale, 2014, 6, 11692. TB Tai, MT Nguyen Nanoscale 7 (7), 3316-3317, 2015 | 37 | 2015 |
Quantum rules for planar boron nanoclusters AG Arvanitidis, TB Tai, MT Nguyen, A Ceulemans Physical Chemistry Chemical Physics 16 (34), 18311-18318, 2014 | 37 | 2014 |