Publications from the Department of Physics, Virginia Commonwealth University.

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Submissions from 2003

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Nitrogen-induced magnetic transition in small chromium clusters, Q. Wang, Q. Sun, B. K. Rao, P. Jena, and Y. Kawazoe

Submissions from 2002

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Magnetic moment and anisotropy in FenCom clusters, J. Kortus, T. Baruah, M. R. Pederson, C. Ashman, and Shiv N. Khanna

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Electronic-structure-based investigation of magnetism in the Fe8 molecular magnet, Mark R. Pederson, Jens Kortus, and S. N. Khanna

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Caging of Ni clusters by benzene molecules and its effect on the magnetism of Ni clusters, B. K. Rao and P. Jena

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Spectroscopy of Ni-n(benzene)(m) anion complexes, B. K. Rao and P. Jena

Submissions from 2001

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Electronic structure and chemical bonding of 3d-metal dimers ScX, X=Sc-Zn, G. L. Gutsev, P. Jena, B. K. Rao, and S. N. Khanna

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Electronic structure of chromium oxides, CrOn- and CrOn (n=1-5) from photoelectron spectroscopy and density functional theory calculations, G. L. Gutsev, P. Jena, Hua-Jin Zhai, and Lai-Sheng Wang

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Investigation of inversion domains in GaN by electric-force microscopy, K. M. Jones, P. Visconti, F. Yun, A. A. Baski, and Hadis Morkoç

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Geometry, electronic structure, and energetics of copper-doped aluminum clusters, S. N. Khanna, C. Ashman, B. K. Rao, and P. Jena

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Reactivity and electronic structure of aluminum clusters: The aluminum-nitrogen system, B. D. Leskiw, A. W. Castleman Jr., C. Ashman, and S. N. Khanna

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Energetics and electronic structure of carbon doped aluminum clusters, B. K. Rao and P. Jena

Submissions from 2000

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Magnetic coupling in neutral and charged Cr-2, Mn-2, and CrMn dimers, N. Desmarais, F. A. Reuse, and S. N. Khanna

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Experimental and theoretical study of the photoelectron spectra of MnOx-(x=1-3) clusters, Gennady L. Gutsev, B. K. Rao, P. Jena, Xi Li, and Lai-Sheng Wang

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Theoretical calculations of magnetic order and anisotropy energies in molecular magnets, M. R. Pederson, D. V. Porezag, J. Kortus, and S. N. Khanna

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Alkalization of aluminum clusters, B. K. Rao and P. Jena

Submissions from 1999

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Search for “quadrupole-bound” anions. I, Gennady L. Gutsev, Puru Jena, and Rodney J. Bartlett

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Structure and stability of the AlX and AlX- species, Gennady L. Gutsev, Puru Jena, and Rodney J. Bartlett

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Thermodynamical stability of CH3ONO and CH3ONO-: A coupled-cluster and Hartree-Fock-density-functional-theory study, Gennady L. Gutsev, Puru Jena, and Rodney J. Bartlett

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Does N-2(-) exist? A coupled-cluster study, Gennady L. Gutsev, Piotr B. Rozyczko, Rodney J. Bartlett, and Charles A. Weatherford

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Evolution of the electronic structure and properties of neutral and charged aluminum clusters: A comprehensive analysis, B. K. Rao and P. Jena

Submissions from 1998

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A Lattice Model for Computing the Transmissivity of the Cornea and Sclera, David B. Ameen, Marilyn F. Bishop, and Tom McMullen

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Dynamics and instabilities near the glass transition: From clusters to crystals, Saroj K. Nayak, Puru Jena, Keith D. Ball, and R. Stephen Berry

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Atomic and electronic structure of neutral and charged SinOm clusters, Saroj K. Nayak, B. K. Rao, S. N. Khanna, and P. Jena

Submissions from 1997

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Structure and magnetism of multiphase Sm0.080Co0.645Fe0.276 powders, V. G. Harris, M. Liou, B. N. Das, V. M. Browning, J. E. Snyder, M. Rubinstein, S. H. Lawrence, R. Littleton III, and D. P. Pappas

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Atomic and electronic structures of neutral and charged boron and boron-rich clusters, J. Niu, B. K. Rao, and P. Jena