OUR CRT PUBLICATIONS
C.J. Umrigar, Julien Toulouse, Claudia Filippi, S. Sorella, and R.G. Hennig
"Alleviation of the Fermion-sign problem by optimization of
many-body wave functions"
Phys. Rev. Lett. 98, 110201 (2007).
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Julien Toulouse and C. J. Umrigar
"Optimization of quantum Monte Carlo wave functions by energy
minimization"
J. Chem. Phys. 126, 084102, (2007).
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A. D. Guclu, Amit Ghosal, C. J. Umrigar, and Harold U.
Baranger,
"Interaction-induced strong localization in quantum dots"
Phys. Rev. B77, 041301 (2008).
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M. Suewattana, W. Purwanto, S. Zhang, H. Krakauer, and E. J.
Walter
"Phaseless auxiliary-field quantum Monte Carlo calculations
with plane
waves and pseudopotentials: Applications to atoms and
molecules"
Phys. Rev. B75, 245123 (2007).
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W. A. Al-Saidi,
Shiwei Zhang, and Henry Krakauer
"Bond breaking with auxiliary-field quantum Monte Carlo"
Journal of Chemical Physics 127, 144101 (2007).
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W. Purwanto, W. A. Al-Saidi, H.
Krakauer, and S. Zhang
"Eliminating spin contamination in auxiliary-field quantum
Monte Carlo:
realistic potential energy curve of F2"
Journal of Chemical Physics 128, 114309 (2008).
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Quan Yin, Alexey Gordienko, Xiangang Wan, and Sergey Y.
Savrasov
" Calculated Momentum Dependence of Zhang-Rice States in Transition
Metal Oxides"
Phys. Rev. Lett. 100, 066406 (2008).
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Xiangang Wan, Quan Yin, and Sergej Y. Savrasov
"Calculation of Magnetic Exchange Interactions in Mott-Hubbard Systems"
Phys. Rev. Lett. 97,
266403 (2006)
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W. A. Al-Saidi, H. Krakauer, and Shiwei Zhang
"A study of H+H2 and
several
H-bonded molecules
by phaseless auxiliary-field quantum Monte Carlo with planewave"
J. Chem. Phys. 126, 194105 (2007).
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Hendra Kwee, Shiwei Zhang, and H. Krakauer
"Finite-size corrections in
many-body electronic
structure calculations"
Phys. Rev. Lett. 100, 126404 (2008).
(2007).
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Y. Zhu, J. C. Zheng, L. Wu, A. I. Frenkel, J.
Hanson, P. Northrup, and W. Ku
"Nanoscale Disorder in CaCu3Ti4O12: A New Route to the Enhanced
Dielectric Response"
Phys. Rev. Lett. 99, 037602 (2007).
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B.C. Larson, Wei
Ku, J. Z. Tischler, Chi-Cheng Lee, O. D. Restrepo, A. G. Eguiluz, P.
Zschack,
and K. D. Finkelstein
"Nonresonant Inelastic X-Ray Scattering and Energy-Resolved
Wannier
Function Investigation of d-d Excitations in NiO and CoO"
Phys. Rev. Lett. 99, 026401 (2007).
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Xiaowei Teng, Wei-Qiang Han, Wei Ku, Markus
Hucker
"Synthesis of Ultrathin Palladium and Platinum Nanowires and a
Study of
Their Magnetic Properties"
Angewandte Chemie International Edition, 47, 2055 (2008).
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K.-W. Lee and W. E. Pickett
"Half Semimetallic Antiferromagnetism in the Sr2CrTO6 System, T = Os,
Ru"
Phys. Rev. B77 115101 (2008).
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K.-W.
Lee, J. Kunes, R. T. Scalettar, and W. E. Pickett
"Correlation Effects in the Triangular Lattice Single-band System
LixNbO2"
Phys. Rev. B 76, 144513 (2007).
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J. Kunes, A. V.
Lukoyanov, V. I. Anisimov, R. T. Scalettar, and W. E. Pickett
"Magnetic Moment Collapse-Driven Mott Transition in MnO"
Nature Materials 7, 198 (2008).
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K.-W. Lee and W. E. Pickett
"Orbital-Quenching-Induced Magnetism in Ba2NaOsO6"
Europhys. Lett. 80, 37008 (2007).
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K.-W. Lee and W. E. Pickett
"Chemical Differences between K and Na in Alkali Cobaltates"
Phys. Rev. B 76, 134510 (2007).
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R. Pentcheva and W. E. Pickett
"Correlation-Driven Charge Order at the Interface between a Mott and a
Band
Insulator"
Phys. Rev. Lett. 99, 016802 (2007).
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D. Kasinathan, K. Koepernik, and W. E. Pickett
"Pressure-Driven Magnetic Moment Collapse in the Ground State of MnO"
New J. Phys. 9, 235 (2007).
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W. E. Pickett and H. Eschrig
"Half Metals: From Formal Theory to Real Material Issues"
J. Phys.: Condens. Matt. 19, 315203 (2007).
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T.A. Maier, A. Macridin, M. Jarrell, and D.J. Scalapino
"Systematic analysis of a spin-susceptibility representation of the
pairing interaction in the 2D Hubbard model"
Phys. Rev. B 76, 144516 (2007).
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T.A. Maier, A. Macridin, M. Jarrell, and D.J. Scalapino
"Systematic analysis of a spin-susceptibility representation of the
pairing interaction in the 2D Hubbard model"
Phys. Rev. Lett. 99, 237001 (2007).
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D.G.S.P. Doluweera, M. Jarrell, T. A. Maier, A. Macridin , and Th.
Pruschke,
"Suppression of d-wave superconductivity in the checkerboard Hubbard
model"
Phys. Rev. B78, 020504(R) (2008).
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Alexandru Macridin and M. Jarrell
"The isotope effect in the Hubbard model with local phonons"
Phys. Rev. B79, 104517 (2009).
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Julien Toulouse and C. J. Umrigar
"Full optimization of Jastrow-Slater wave functions: application
to the
first-row atoms and homonuclear diatomic molecules"
J. Chem. Phys. 128, 174101 (2008).
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Shiwei Zhang and David Ceperley
"The Hartree-Fock ground state of the
electron gas"
Phys. Rev. Lett. 100, 236404 (2008)
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Weiguo Yin and Wei Ku
"Role of apical oxygen atoms on hole mobility and local pairing
interaction in high-Tc cuprates"
Phys. Rev. B 79, 214512 (2009).
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M. H. Upton, R. F. Klie, J. P. Hill, T. Gog, D. Casa, W. Ku, Y. Zhu, M.
Y. Sfeir, J. Misewich, G. Eres, D. Lowndes
"Effect of Number of Walls on Plasmon Behavior in Carbon
Nanotubes"
submitted to Phys. Rev. B (2006).
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Peter Abbamonte, Tim Graber, James P. Reed, Serban Smadici,
ChenLin Yeh, Abhay Shukla, Jean-Pascal Rueff, and Wei Ku
"Dynamical reconstruction of the exciton in LiF with inelastic
X-ray
scattering"
PNAS 105, 12159 (2008).
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A.K. McMahan, R.T. Scalettar and M. Jarrell
"Screening of 4f moments and delocalization in the compressed light rare
earths"
Phys. Rev. B80, 235105 (2009).
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