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Xavier Blase

Centre National de la Recherche Scientifique

H指数:59

被引数:1.5万

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Anomalous propagators and the particle-particle channel: Bethe-Salpeter equation

异常传播子与粒子-粒子通道：Bethe-Salpeter方程

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2025-04-030

OA

Joint approximate diagonalization approach to quasiparticle self-consistent GW calculations

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2025-02-070

PRE

From Many-Body Ab Initio to Effective Excitonic Models: A Versatile Mapping Approach Including Environmental Embedding Effects

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2024-09-181

PRE

Reference CC3 Excitation Energies for Organic Chromophores: Benchmarking TD-DFT, BSE/GW, and Wave Function Methods

有机发色团的参考CC3激发能: 基准测试td-dft，BSE/GW和波函数方法

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2024-09-054

PRE

Polarizable Continuum Models and Green's Function GW Formalism: On the Dynamics of the Solvent Electrons

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2024-09-030

OA

Preempted phonon-mediated superconductivity in the infinite-layer nickelates

PHYSICAL REVIEW B

IF3.7

2024-05-038

OA

Static versus dynamically polarizable environments within the many-body GW formalism

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2024-04-165

OA

Disentangling the multiorbital contributions of excitons by photoemission exciton tomography (Vol 15,1804, 2024)

NATURE COMMUNICATIONS

IF15.7

2024-04-150

OAAI

Assessing the accuracy of TD-DFT excited-state geometries through optimal tuning with GW energy levels

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2024-04-112

OA

Disentangling the multiorbital contributions of excitons by photoemission exciton tomography

NATURE COMMUNICATIONS

IF15.7

2024-02-289

OAAI

Many-body GW calculations with very large scale polarizable environments made affordable: A fully ab initio QM/QM approach

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2023-10-246

OA

Lagrangian Z-vector approach to Bethe-Salpeter analytic gradients: Assessing approximations

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2023-07-118

OA

Modeling of excited state potential energy surfaces with the Bethe-Salpeter equation formalism: The 4-(dimethylamino)benzonitrile twist

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2022-11-1511

OA

Universal polarization energies for defects in monolayer, surface, and bulk hexagonal boron nitride: A finite-size fragments GW approach

PHYSICAL REVIEW MATERIALS

IF3.4

2022-06-2112

OA

Doping of semicrystalline conjugated polymers: dopants within alkyl chains do it better

JOURNAL OF MATERIALS CHEMISTRY C

IF5.1

2022-01-0117

OA

Doping-Induced Dielectric Catastrophe Prompts Free-Carrier Release in Organic Semiconductors

掺杂引起的介电灾难促使有机半导体中的自由载流子释放

ADVANCED MATERIALS

IF26.8

2021-11-0717

OA

Photoluminescent properties of the carbon-dimer defect in hexagonal boron-nitride: A many-body finite-size cluster approach

PHYSICAL REVIEW MATERIALS

IF3.4

2021-09-3031

OA

Reference Energies for Intramolecular Charge-Transfer Excitations

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2021-05-0682

OAAI

Cubic-Scaling All-Electron GW Calculations with a Separable Density-Fitting Space-Time Approach

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2021-04-0269

OA

Bethe-Salpeter Study of the Optical Absorption of trans and cis Azobenzene-Functionalized Metal-Organic Frameworks Using Molecular and Periodic Models

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2021-03-268

OA