Publications from the Department of Physics, Virginia Commonwealth University.

Follow

Submissions from 2011

PDF

Stability and electronic structure of bilayer graphone, J. Zhou, Q. Wang, Q. Sun, and Puru Jena

Submissions from 2010

PDF

Structures of neutral and anionic Au16 clusters revisited, Gang Chen, Qian Wang, Qiang Sun, Yoshiyuki Kawazoe, and Puru Jena

PDF

The applicability of three-dimensional aromaticity in BiSnn- Zintl analogues, Penee A. Clayborne, Ujjwal Gupta, Arthur C. Reber, Joshua J. Melko, Shiv N. Khanna, and A. W. Castleman Jr.

PDF

Magnetism in ZnO nanowire with Fe/Co codoping: First-principles density functional calculations, S. Ghosh, Q. Wang, G. P. Das, and Puru Jena

PDF

Electronic structure and properties of isoelectronic magic clusters: Al13X (X=H,Au,Li,Na,K,Rb,Cs), Yeon Jae Ko, Anisha Shakya, Haopeng Wang, Andrej Grubisic, Weijun Zheng, Matthias Gotz, Gerd Gantefor, Kit H. Bowen, Puru Jena, and Boggavarapu Kiran

PDF

Communications: Chain and double-ring polymeric structures: Observation of AlnH3n+1− (n=4–8) and Al4H14, Xiang Li, Andrej Grubisic, Kit H. Bowen, Anil K. Kandalam, Boggavarapu Kiran, Gerd Gantefor, and Puru Jena

PDF

Negative ions of transition metal-halogen clusters, Kalpataru Pradhan, Gennady L. Gutsev, and Purusottam Jena

PDF

Enhanced magnetic moments of alkali metal coated Sc clusters: New magnetic superatoms, Kalpataru Pradhan, J. Ulises Reveles, Prasenjit Sen, and S. N. Khanna

PDF

Surface photovoltage in undoped n-type GaN, M. A. Reshchikov, M. Foussekis, and A. A. Baski

PDF

Crystal field effects on the reactivity of aluminum-copper cluster anions, Patrick J. Roach, W. Hunter Woodward, Arthur C. Reber, Shiv N. Khanna, and A. W. Castleman Jr.

PDF

Oxidation of Pdn (n=1–7,10) clusters supported on alumina/NiAl(110), R. Robles and Shiv N. Khanna

PDF

Magnetic moment and local moment alignment in anionic and/or oxidized Fen clusters, D. R. Roy, R. Robles, and S. N. Khanna

PDF

Probing the existence of energetically degenerate cluster isomers by chemical tagging, Qian Wang, Qiang Sun, and Puru Jena

PDF

First-principles study of hydrogen adsorption in metal-doped COF-10, Miao Miao Wu, Qian Wang, Qiang Sun, Puru Jena, and Yoshiyuki Kawazoe

PDF

Electronic and magnetic properties of a BN sheet decorated with hydrogen and fluorine, Jian Zhou, Qian Wang, Qiang Sun, and Puru Jena

Submissions from 2009

PDF

Photoadsorption and photodesorption for GaN, M. Foussekis, A. A. Baski, and Michael A. Reshchikov

PDF

Al13H−: Hydrogen atom site selectivity and the shell model, A. Grubisic, X. Li, S. T. Stokes, K. Vetter, G. F. Ganteför, K. H. Bowen, P. Jena, B. Kiran, R. Burgert, and H. Schnöckel

PDF

Highly efficient (Cs8V) superatom-based spin-polarizer, Haiying He, Ravindra Pandey, J. Ulises Reveles, Shiv N. Khanna, and Shashi P. Karna

PDF

Origin of the anatase to rutile conversion of metal-doped TiO2, Sa Li and Puru Jena

PDF

Magnetic response of core-shell cobalt ferrite nanoparticles at low temperature, K. Maaz, M. Usman, S. Karim, A. Mumtaz, S. K. Hasanain, and M. F. Bertino

PDF

Electronic behavior of the Zn- and O-polar ZnO surfaces studied using conductive atomic force microscopy, J. C. Moore, S. M. Kenny, C. S. Baird, H. Morkoç, and A. A. Baski

PDF

Magnetism in assembled and supported silicon endohedral cages: First-principles electronic structure calculations, R. Robles and Shiv N. Khanna

PDF

Stable T2Sin (T=Fe,Co,Ni,1≤n≤8) cluster motifs, R. Robles and S. N. Khanna

PDF

Photoelectron imaging and theoretical investigation of bimetallic Bi1–2Ga−0–2 and Pb−1–4 cluster anions, M. A. Sobhy, J. Ulises Reveles, Ujjwal Gupta, Shiv N. Khanna, and A. W. Castleman Jr.

PDF

Functionalized heterofullerenes for hydrogen storage, Qiang Sun, Qian Wang, and Puru Jena