Gunaretnam Rajagopal
Gunaretnam Rajagopal
Janssen R&D
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Quantum Monte Carlo simulations of solids
WMC Foulkes, L Mitas, RJ Needs, G Rajagopal
Reviews of Modern Physics 73 (1), 33, 2001
Calculations of silicon self-interstitial defects
WK Leung, RJ Needs, G Rajagopal, S Itoh, S Ihara
Physical review letters 83 (12), 2351, 1999
Finite-size effects and Coulomb interactions in quantum Monte Carlo calculations for homogeneous systems with periodic boundary conditions
LM Fraser, WMC Foulkes, G Rajagopal, RJ Needs, SD Kenny, ...
Physical Review B 53 (4), 1814, 1996
Patterns and barriers for fission of charged small metal clusters
RN Barnett, U Landman, G Rajagopal
Physical review letters 67 (22), 3058, 1991
Monte Carlo energy and variance-minimization techniques for optimizing many-body wave functions
PRC Kent, RJ Needs, G Rajagopal
Physical Review B 59 (19), 12344, 1999
The tumor suppressor p53: cancer and aging
Z Feng, W Hu, G Rajagopal, AJ Levine
Cell Cycle 7 (7), 842-847, 2008
casino version 2.1 User Manual
RJ Needs, MD Towler, ND Drummond, PL Ríos
University of Cambridge, Cambridge, 2007
Carbon clusters near the crossover to fullerene stability
PRC Kent, MD Towler, RJ Needs, G Rajagopal
Physical Review B 62 (23), 15394, 2000
Elimination of Coulomb finite-size effects in quantum many-body simulations
AJ Williamson, G Rajagopal, RJ Needs, LM Fraser, WMC Foulkes, ...
Physical Review B 55 (8), R4851, 1997
Identifying microRNA/mRNA dysregulations in ovarian cancer
GD Miles, M Seiler, L Rodriguez, G Rajagopal, G Bhanot
BMC research notes 5 (1), 1-10, 2012
Finite-size errors in quantum many-body simulations of extended systems
PRC Kent, RQ Hood, AJ Williamson, RJ Needs, WMC Foulkes, ...
Physical Review B 59 (3), 1917, 1999
Metallization of ionic clusters
G Rajagopal, RN Barnett, U Landman
Physical review letters 67 (6), 727, 1991
Optical spectra of localized excess electrons in alkali halide clusters
G Rajagopal, RN Barnett, A Nitzan, U Landman, EC Honea, P Labastie, ...
Physical review letters 64 (24), 2933, 1990
Variational and diffusion quantum Monte Carlo calculations at nonzero wave vectors: Theory and application to diamond-structure germanium
G Rajagopal, RJ Needs, A James, SD Kenny, WMC Foulkes
Physical Review B 51 (16), 10591, 1995
Quantum monte carlo investigation of exchange and correlation in silicon
RQ Hood, MY Chou, AJ Williamson, G Rajagopal, RJ Needs, ...
Physical review letters 78 (17), 3350, 1997
Born–Oppenheimer dynamics using density‐functional theory: Equilibrium and fragmentation of small sodium clusters
RN Barnett, U Landman, A Nitzan, G Rajagopal
The Journal of chemical physics 94 (1), 608-616, 1991
Diffusion quantum Monte Carlo calculations of the excited states of silicon
AJ Williamson, RQ Hood, RJ Needs, G Rajagopal
Physical Review B 57 (19), 12140, 1998
Quantum Monte Carlo calculations for solids using special k points methods
G Rajagopal, RJ Needs, S Kenny, WMC Foulkes, A James
Physical review letters 73 (14), 1959, 1994
Optimized wave functions for quantum Monte Carlo studies of atoms and solids
AJ Williamson, SD Kenny, G Rajagopal, AJ James, RJ Needs, LM Fraser, ...
Physical Review B 53 (15), 9640, 1996
Exchange and correlation in silicon
RQ Hood, MY Chou, AJ Williamson, G Rajagopal, RJ Needs
Physical Review B 57 (15), 8972, 1998
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