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Can Single-Reference Coupled Cluster Theory Describe Static Correlation?

Journal of chemical theory and computation, 2015-07, Vol.11 (7), p.3171-3179

2015

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Semilocal and hybrid meta-generalized gradient approximations based on the understanding of the kinetic-energy-density dependence

The Journal of chemical physics, 2013-01, Vol.138 (4), p.044113-044113

2013

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Particle-particle and quasiparticle random phase approximations: connections to coupled cluster theory

The Journal of chemical physics, 2013-09, Vol.139 (10), p.104113-104113

2013

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Electron correlation in solids via density embedding theory

The Journal of chemical physics, 2014-08, Vol.141 (5), p.054113-054113

2014

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Pair extended coupled cluster doubles

The Journal of chemical physics, 2015-06, Vol.142 (21), p.214116-214116

2015

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Blind test of density-functional-based methods on intermolecular interaction energies

The Journal of chemical physics, 2016-09, Vol.145 (12), p.124105

2016

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Noncollinear density functional theory having proper invariance and local torque properties

Physical review. B, Condensed matter and materials physics, 2013-01, Vol.87 (3), Article 035117

2013

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Density matrix embedding from broken symmetry lattice mean fields

Physical review. B, Condensed matter and materials physics, 2014-01, Vol.89 (3), Article 035140

2014

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Time-resolved photoluminescence spectroscopy for the detection of cysteine and other thiol containing amino acids in complex strongly autofluorescent media

Chemical communications (Cambridge, England), 2012-01, Vol.48 (96), p.11760-11762

2012

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Electronic and vibrational contributions to first hyperpolarizability of donor-acceptor-substituted azobenzene

The Journal of chemical physics, 2010-12, Vol.133 (24), p.244308-244308-7

2010

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Seniority-based coupled cluster theory

The Journal of chemical physics, 2014-12, Vol.141 (24), p.244104-244104

2014

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Solutions of the Two-Dimensional Hubbard Model: Benchmarks and Results from a Wide Range of Numerical Algorithms

Physical review. X, 2015-12, Vol.5 (4), p.041041, Article 041041

2015

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Vibrational self-consistent field theory using optimized curvilinear coordinates

The Journal of chemical physics, 2017-07, Vol.147 (4), p.044110-044110

2017

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Synergy between pair coupled cluster doubles and pair density functional theory

The Journal of chemical physics, 2015-01, Vol.142 (4), p.044109-044109

2015

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Range separated hybrids of pair coupled cluster doubles and density functionals

Physical chemistry chemical physics : PCCP, 2015-01, Vol.17 (34), p.22412-22422

2015

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Fixed-Node, Importance-Sampling Diffusion Monte Carlo for Vibrational Structure with Accurate and Compact Trial States

Journal of chemical theory and computation, 2018-03, Vol.14 (3), p.1554-1563

2018

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Combinations of coupled cluster, density functionals, and the random phase approximation for describing static and dynamic correlation, and van der Waals interactions

Molecular physics, 2016-04, Vol.114 (7-8), p.997-1018

2016

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Performance of density functional theory in computing nonresonant vibrational (hyper)polarizabilities

Journal of computational chemistry, 2013-07, Vol.34 (20), p.1775-1784

2013

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Proper and improper zero energy modes in Hartree-Fock theory and their relevance for symmetry breaking and restoration

The Journal of chemical physics, 2013-10, Vol.139 (15), p.154107-154107

2013

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Semilocal exchange hole with an application to range-separated density functionals

Physical review. B, 2017-03, Vol.95 (12), p.125115, Article 125115

2017

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Synergy between pair coupled cluster doubles and pair density functional theory

The Journal of chemical physics, 2015-01, Vol.142 (4)

2015

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Seniority-based coupled cluster theory

The Journal of chemical physics, 2014-12, Vol.141 (24)

2014

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Time-resolved photoluminescence spectroscopy for the detection of cysteine and other thiol containing amino acids in complex strongly autofluorescent mediaElectronic supplementary information (ESI) available. See DOI: 10.1039/c2cc36588j

2012-11

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Range separated hybrids of pair coupled cluster doubles and density functionals

Physical chemistry chemical physics : PCCP, 2015-01, Vol.17 (34)

2015

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Blind test of density-functional-based methods on intermolecularinteraction energies

The Journal of chemical physics, 2016-09, Vol.145 (12)

2016

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Can Single-Reference Coupled Cluster Theory Describe Static Correlation?

Semilocal and hybrid meta-generalized gradient approximations based on the understanding of the kinetic-energy-density dependence

Particle-particle and quasiparticle random phase approximations: connections to coupled cluster theory

Electron correlation in solids via density embedding theory

Pair extended coupled cluster doubles

Blind test of density-functional-based methods on intermolecular interaction energies

Noncollinear density functional theory having proper invariance and local torque properties

Density matrix embedding from broken symmetry lattice mean fields

Time-resolved photoluminescence spectroscopy for the detection of cysteine and other thiol containing amino acids in complex strongly autofluorescent media

Electronic and vibrational contributions to first hyperpolarizability of donor-acceptor-substituted azobenzene

Seniority-based coupled cluster theory

Solutions of the Two-Dimensional Hubbard Model: Benchmarks and Results from a Wide Range of Numerical Algorithms

Vibrational self-consistent field theory using optimized curvilinear coordinates

Synergy between pair coupled cluster doubles and pair density functional theory

Range separated hybrids of pair coupled cluster doubles and density functionals

Fixed-Node, Importance-Sampling Diffusion Monte Carlo for Vibrational Structure with Accurate and Compact Trial States

Combinations of coupled cluster, density functionals, and the random phase approximation for describing static and dynamic correlation, and van der Waals interactions

Performance of density functional theory in computing nonresonant vibrational (hyper)polarizabilities

Proper and improper zero energy modes in Hartree-Fock theory and their relevance for symmetry breaking and restoration

Semilocal exchange hole with an application to range-separated density functionals

Synergy between pair coupled cluster doubles and pair density functional theory

Seniority-based coupled cluster theory

Time-resolved photoluminescence spectroscopy for the detection of cysteine and other thiol containing amino acids in complex strongly autofluorescent mediaElectronic supplementary information (ESI) available. See DOI: 10.1039/c2cc36588j

Range separated hybrids of pair coupled cluster doubles and density functionals

Blind test of density-functional-based methods on intermolecularinteraction energies

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