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Vertex effects in describing the ionization energies of the first-row transition-metal monoxide molecules

The Journal of chemical physics, 2022-12, Vol.157 (21), p.214115-214115

2022

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Random-phase approximation and its applications in computational chemistry and materials science

Journal of materials science, 2012-11, Vol.47 (21), p.7447-7471

2012

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Developing correlation-consistent numeric atom-centered orbital basis sets for krypton: Applications in RPA-based correlated calculations

The Journal of chemical physics, 2024-01, Vol.160 (2)

2024

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All-electron ab initio Bethe-Salpeter equation approach to neutral excitations in molecules with numeric atom-centered orbitals

The Journal of chemical physics, 2020-01, Vol.152 (4), p.044105-044105

2020

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Phase stability of the argon crystal: first-principles study based on random phase approximation plus renormalized single excitation corrections

New journal of physics, 2022-03, Vol.24 (3), p.33049

2022

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Beyond the random-phase approximation for the electron correlation energy: the importance of single excitations

Physical review letters, 2011-04, Vol.106 (15), p.153003-153003, Article 153003

2011

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First-principles study of benzo[a]pyrene-7,8-dione and DNA adducts

The Journal of chemical physics, 2021-05, Vol.154 (17), p.175102-175102

2021

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Role of exact exchange in the structural and electronic properties of the α and γ phases of cerium: a density functional theory study

New journal of physics, 2022-09, Vol.24 (9), p.93032

2022

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Exploring the random phase approximation: Application to CO adsorbed on Cu(111)

Physical review. B, Condensed matter and materials physics, 2009-07, Vol.80 (4), Article 045402

2009

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Accurate Ionization Potentials and Electron Affinities of Acceptor Molecules III: A Benchmark of GW Methods

Journal of chemical theory and computation, 2016-02, Vol.12 (2), p.615-626

2016

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Accurate localized resolution of identity approach for linear-scaling hybrid density functionals and for many-body perturbation theory

New journal of physics, 2015-09, Vol.17 (9), p.93020

2015

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Abnormal protein and mRNA expression of inflammatory cytokines in the prefrontal cortex of depressed individuals who died by suicide

Journal of psychiatry & neuroscience, 2018-11, Vol.43 (6), p.376-385

2018

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Numeric atom-centered-orbital basis sets with valence-correlation consistency from H to Ar

New journal of physics, 2013-12, Vol.15 (12), p.123033-31

2013

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Abnormal gene and protein expression of inflammatory cytokines in the postmortem brain of schizophrenia patients

Schizophrenia research, 2018-02, Vol.192, p.247-254

2018

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Structure and energetics of benzene adsorbed on transition-metal surfaces: density-functional theory with van der Waals interactions including collective substrate response

New journal of physics, 2013-05, Vol.15 (5), p.53046-27

2013

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Toll-like receptors in the depressed and suicide brain

Journal of psychiatric research, 2014-06, Vol.53, p.62-68

2014

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Proinflammatory cytokines in the prefrontal cortex of teenage suicide victims

Journal of psychiatric research, 2012-01, Vol.46 (1), p.57-63

2012

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Peculiar diffusion behavior of AlCl4 intercalated in graphite from nanosecond-long molecular dynamics simulations

中国物理B（英文版）, 2021-11, Vol.30 (10), p.113-119

2021

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Main-group test set for materials science and engineering with user-friendly graphical tools for error analysis: systematic benchmark of the numerical and intrinsic errors in state-of-the-art electronic-structure approximations

New journal of physics, 2019-01, Vol.21 (1), p.13025

2019

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Evidence for temporary and local transition of sp2 graphite-type to sp3 diamond-type bonding induced by the tip of an atomic force microscope

New journal of physics, 2022-08, Vol.24 (8), p.083018

2022

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Region-specific alterations in glucocorticoid receptor expression in the postmortem brain of teenage suicide victims

Psychoneuroendocrinology, 2013-11, Vol.38 (11), p.2628-2639

2013

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First-principles calculation of optical responses based on nonorthogonal localized orbitals

New journal of physics, 2019-09, Vol.21 (9), p.93001

2019

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The origin of hyperferroelectricity in LiBO3 (B = V, Nb, Ta, Os)

Scientific reports, 2016-10, Vol.6 (1), p.34085-34085, Article 34085

2016

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Alteration of cyclic-AMP response element binding protein in the postmortem brain of subjects with bipolar disorder and schizophrenia

Journal of affective disorders, 2014-01, Vol.152, p.326-333

2014

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Lower docosahexaenoic acid concentrations in the postmortem prefrontal cortex of adult depressed suicide victims compared with controls without cardiovascular disease

Journal of psychiatric research, 2013-09, Vol.47 (9), p.1187-1191

2013

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Vertex effects in describing the ionization energies of the first-row transition-metal monoxide molecules

Random-phase approximation and its applications in computational chemistry and materials science

Developing correlation-consistent numeric atom-centered orbital basis sets for krypton: Applications in RPA-based correlated calculations

All-electron ab initio Bethe-Salpeter equation approach to neutral excitations in molecules with numeric atom-centered orbitals

Phase stability of the argon crystal: first-principles study based on random phase approximation plus renormalized single excitation corrections

Beyond the random-phase approximation for the electron correlation energy: the importance of single excitations

First-principles study of benzo[a]pyrene-7,8-dione and DNA adducts

Role of exact exchange in the structural and electronic properties of the α and γ phases of cerium: a density functional theory study

Exploring the random phase approximation: Application to CO adsorbed on Cu(111)

Accurate Ionization Potentials and Electron Affinities of Acceptor Molecules III: A Benchmark of GW Methods

Accurate localized resolution of identity approach for linear-scaling hybrid density functionals and for many-body perturbation theory

Abnormal protein and mRNA expression of inflammatory cytokines in the prefrontal cortex of depressed individuals who died by suicide

Numeric atom-centered-orbital basis sets with valence-correlation consistency from H to Ar

Abnormal gene and protein expression of inflammatory cytokines in the postmortem brain of schizophrenia patients

Structure and energetics of benzene adsorbed on transition-metal surfaces: density-functional theory with van der Waals interactions including collective substrate response

Toll-like receptors in the depressed and suicide brain

Proinflammatory cytokines in the prefrontal cortex of teenage suicide victims

Peculiar diffusion behavior of AlCl4 intercalated in graphite from nanosecond-long molecular dynamics simulations

Main-group test set for materials science and engineering with user-friendly graphical tools for error analysis: systematic benchmark of the numerical and intrinsic errors in state-of-the-art electronic-structure approximations

Evidence for temporary and local transition of sp2 graphite-type to sp3 diamond-type bonding induced by the tip of an atomic force microscope

Region-specific alterations in glucocorticoid receptor expression in the postmortem brain of teenage suicide victims

First-principles calculation of optical responses based on nonorthogonal localized orbitals

The origin of hyperferroelectricity in LiBO3 (B = V, Nb, Ta, Os)

Alteration of cyclic-AMP response element binding protein in the postmortem brain of subjects with bipolar disorder and schizophrenia

Lower docosahexaenoic acid concentrations in the postmortem prefrontal cortex of adult depressed suicide victims compared with controls without cardiovascular disease

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