Hyperhalogens: discovery of a new class of highly electronegative species M Willis, M Götz, AK Kandalam, GF Ganteför, P Jena
Angewandte Chemie International Edition 49 (47), 8966-8970, 2010
160 2010 Hydrogen storage and the 18-electron rule B Kiran, AK Kandalam, P Jena
The Journal of chemical physics 124 (22), 2006
152 2006 Geometry and electronic structure of AK Kandalam, BK Rao, P Jena, R Pandey
The Journal of chemical physics 120 (22), 10414-10422, 2004
145 2004 First principles study of polyatomic clusters of AlN, GaN, and InN. 1. Structure, stability, vibrations, and ionization AK Kandalam, R Pandey, MA Blanco, A Costales, JM Recio, JM Newsam
The Journal of Physical Chemistry B 104 (18), 4361-4367, 2000
144 2000 Structure and bonding of Au 5 M (M= Na, Mg, Al, Si, P, and S) clusters C Majumder, AK Kandalam, P Jena
Physical Review B 74 (20), 205437, 2006
140 2006 Theoretical study of structural and vibrational properties of (AlP) n,(AlAs) n,(GaP) n,(GaAs) n,(InP) n, and (InAs) n clusters with n= 1, 2, 3 A Costales, AK Kandalam, R Franco, R Pandey
The Journal of Physical Chemistry B 106 (8), 1940-1944, 2002
133 2002 Theoretical Study of Aln n n n n n n = 4, 5, 6) Clusters AK Kandalam, MA Blanco, R Pandey
The Journal of Physical Chemistry B 106 (8), 1945-1953, 2002
117 2002 Superhalogen properties of fluorinated coinage metal clusters P Koirala, M Willis, B Kiran, AK Kandalam, P Jena
The Journal of Physical Chemistry C 114 (38), 16018-16024, 2010
116 2010 2.1 Manganese-Based Magnetic Superhalogens MM Wu, Q Sun, H Wang, YJ Ko, KH Bowen, Q Wang, P Jena, B Kiran, ...
PHOTOELECTRON SPECTROSCOPY OF CLUSTER ANIONS: IN SEARCH OF BUILDING BLOCKS …, 2012
97 2012 Theoretical Study of Structural and Vibrational Properties of Al3 N3 , Ga3 N3 , and In3 N3 AK Kandalam, MA Blanco, R Pandey
The Journal of Physical Chemistry B 105 (26), 6080-6084, 2001
95 2001 Chemical bonding in group III nitrides A Costales, MA Blanco, Á Martín Pendás, AK Kandalam, R Pandey
Journal of the American Chemical Society 124 (15), 4116-4123, 2002
93 2002 Effect of Au coating on the magnetic and structural properties of Fe nanoclusters for use in biomedical applications: A density-functional theory study Q Sun, AK Kandalam, Q Wang, P Jena, Y Kawazoe, M Marquez
Physical Review B 73 (13), 134409, 2006
78 2006 Origin of the Unusual Stability of B12 and B13 + Clusters B Kiran, G Gopa Kumar, MT Nguyen, AK Kandalam, P Jena
Inorganic Chemistry 48 (21), 9965-9967, 2009
64 2009 Theoretical Study of Neutral and Anionic Group III Nitride Clusters: Mn n n = 4−6) A Costales, AK Kandalam, R Pandey
The Journal of Physical Chemistry B 107 (19), 4508-4514, 2003
62 2003 First principles study of polyatomic clusters of AlN, GaN, and InN. 2. Chemical bonding A Costales, AK Kandalam, A Martín Pendás, MA Blanco, JM Recio, ...
The Journal of Physical Chemistry B 104 (18), 4368-4374, 2000
61 2000 Aluminum Zintl anion moieties within sodium aluminum clusters H Wang, X Zhang, YJ Ko, A Grubisic, X Li, G Ganteför, H Schnöckel, ...
The Journal of Chemical Physics 140 (5), 2014
58 2014 Multidecker organometallic complexes for hydrogen storage AK Kandalam, B Kiran, P Jena
The Journal of Physical Chemistry C 112 (15), 6181-6185, 2008
54 2008 Structures and photoelectron spectroscopy of Cun (BO2) m−(n, m= 1, 2) clusters: Observation of hyperhalogen behavior Y Feng, HG Xu, W Zheng, H Zhao, AK Kandalam, P Jena
The Journal of chemical physics 134 (9), 2011
51 2011 Origin of the Unusual Properties of Aun 2 ) Clusters M Götz, M Willis, AK Kandalam, GF Ganteför, P Jena
ChemPhysChem 11 (4), 853-858, 2010
49 2010 Lithium− Benzene Sandwich Compounds: A Quantum Chemical Study JM Vollmer, AK Kandalam, LA Curtiss
The Journal of Physical Chemistry A 106 (41), 9533-9537, 2002
49 2002 
P JenaDistinguished Professor of Physics, Virginia Commonwealth UniversityEmail verificata su vcu.edu
