George Booth
George Booth
Royal Society Research Fellow, King's College London
Verified email at kcl.ac.uk - Homepage
TitleCited byYear
Fermion Monte Carlo without fixed nodes: A game of life, death, and annihilation in Slater determinant space
GH Booth, AJW Thom, A Alavi
The Journal of chemical physics 131 (5), 054106, 2009
3912009
Towards an exact description of electronic wavefunctions in real solids
GH Booth, A Grüneis, G Kresse, A Alavi
Nature 493 (7432), 365, 2013
3562013
Communications: Survival of the fittest: Accelerating convergence in full configuration-interaction quantum Monte Carlo
D Cleland, GH Booth, A Alavi
The Journal of chemical physics 132 (4), 041103, 2010
2012010
PySCF: the Python‐based simulations of chemistry framework
Q Sun, TC Berkelbach, NS Blunt, GH Booth, S Guo, Z Li, J Liu, ...
Wiley Interdisciplinary Reviews: Computational Molecular Science 8 (1), e1340, 2018
1282018
Breaking the carbon dimer: The challenges of multiple bond dissociation with full configuration interaction quantum Monte Carlo methods
GH Booth, D Cleland, AJW Thom, A Alavi
The Journal of chemical physics 135 (8), 084104, 2011
1012011
Approaching chemical accuracy using full configuration-interaction quantum Monte Carlo: A study of ionization potentials
GH Booth, A Alavi
The Journal of chemical physics 132 (17), 174104, 2010
992010
Convergence of many-body wave-function expansions using a plane-wave basis: From homogeneous electron gas to solid state systems
JJ Shepherd, A Grüneis, GH Booth, G Kresse, A Alavi
Physical Review B 86 (3), 035111, 2012
972012
Full configuration interaction perspective on the homogeneous electron gas
JJ Shepherd, G Booth, A Grüneis, A Alavi
Physical Review B 85 (8), 081103, 2012
922012
Investigation of the full configuration interaction quantum Monte Carlo method using homogeneous electron gas models
JJ Shepherd, GH Booth, A Alavi
The Journal of chemical physics 136 (24), 244101, 2012
892012
Natural orbitals for wave function based correlated calculations using a plane wave basis set
A Grüneis, GH Booth, M Marsman, J Spencer, A Alavi, G Kresse
Journal of chemical theory and computation 7 (9), 2780-2785, 2011
742011
A study of electron affinities using the initiator approach to full configuration interaction quantum Monte Carlo
DM Cleland, GH Booth, A Alavi
The Journal of chemical physics 134 (2), 024112, 2011
742011
Spectroscopic accuracy directly from quantum chemistry: Application to ground and excited states of beryllium dimer
S Sharma, T Yanai, GH Booth, CJ Umrigar, GKL Chan
The Journal of chemical physics 140 (10), 104112, 2014
662014
Taming the first-row diatomics: a full configuration interaction quantum monte carlo study
D Cleland, GH Booth, C Overy, A Alavi
Journal of chemical theory and computation 8 (11), 4138-4152, 2012
662012
Linear-scaling and parallelisable algorithms for stochastic quantum chemistry
GH Booth, SD Smart, A Alavi
Molecular Physics 112 (14), 1855-1869, 2014
612014
Unbiased reduced density matrices and electronic properties from full configuration interaction quantum Monte Carlo
C Overy, GH Booth, NS Blunt, JJ Shepherd, D Cleland, A Alavi
The Journal of chemical physics 141 (24), 244117, 2014
542014
Full configuration interaction excitations of ethene and butadiene: Resolution of an ancient question
C Daday, S Smart, GH Booth, A Alavi, C Filippi
Journal of chemical theory and computation 8 (11), 4441-4451, 2012
522012
Semi-stochastic full configuration interaction quantum Monte Carlo: Developments and application
NS Blunt, SD Smart, JAF Kersten, JS Spencer, GH Booth, A Alavi
The Journal of chemical physics 142 (18), 184107, 2015
492015
Stochastic multiconfigurational self-consistent field theory
RE Thomas, Q Sun, A Alavi, GH Booth
Journal of chemical theory and computation 11 (11), 5316-5325, 2015
472015
Communication: Excited states, dynamic correlation functions and spectral properties from full configuration interaction quantum Monte Carlo
GH Booth, GKL Chan
The Journal of chemical physics 137 (19), 191102, 2012
462012
Explicitly correlated plane waves: Accelerating convergence in periodic wavefunction expansions
A Grüneis, JJ Shepherd, A Alavi, DP Tew, GH Booth
The Journal of chemical physics 139 (8), 084112, 2013
442013
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Articles 1–20