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Matthieu Saubanère

École nationale supérieure de chimie de Montpellier

H指数:23

被引数:5,787

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Variational minimization scheme for the one-particle reduced density matrix functional theory in the ensemble N-representability domain

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2024-08-151

OA

Designing Strain-Less Electrode Materials: Computational Analysis of Volume Variations in Li-Ion and Na-Ion Batteries

设计无应变电极材料: 锂离子和钠离子电池体积变化的计算分析

BATTERIES-BASEL

IF4.8

2024-07-250

OA

Unitary transformations within density matrix embedding approaches: A perspective on the self-consistent scheme for electronic structure calculation

PHYSICAL REVIEW B

IF3.7

2023-10-121

OA

Recursive relations and quantum eigensolver algorithms within modified Schrieffer-Wolff transformations for the Hubbard dimer

PHYSICAL REVIEW B

IF3.7

2023-04-061

OA

Quantum embedding of multi-orbital fragments using the block-Householder transformation

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2022-12-058

OA

Influence of local structural distortion on the magnetism of Na2IrO3 compounds

PHYSICAL REVIEW B

IF3.7

2022-03-106

PRE

Householder-transformed density matrix functional embedding theory

PHYSICAL REVIEW B

IF3.7

2021-07-0912

OAAI

Structure, Magnetism, and First-Principles Modeling of the Na0.5La0.5RuO3 Perovskite

CHEMISTRY OF MATERIALS

IF7

2021-01-147

OAAI

The Structural Stability of P2-Layered Na-Based Electrodes during Anionic Redox

阴离子氧化还原过程中P2-Layered Na基电极的结构稳定性

IF35.4

2020-02-0199

OAAI

Unified picture of anionic redox in Li/Na-ion batteries (vol 18, pg 496, 2019)

NATURE MATERIALS

IF38.5

2019-11-110

OAAI

Site-occupation Green's function embedding theory: A density functional approach to dynamical impurity solvers

PHYSICAL REVIEW B

IF3.7

2019-11-044

OAAI

Alkali-Glass Behavior in Honeycomb-Type Layered Li3-xNaxNi2SbO6 Solid Solution

INORGANIC CHEMISTRY

IF4.7

2019-08-2216

OAAI

Charge Transfer Band Gap as an Indicator of Hysteresis in Li-Disordered Rock Salt Cathodes for Li-Ion Batteries

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

IF15.6

2019-06-2593

OAAI

Unified picture of anionic redox in Li/Na-ion batteries

Li/Na离子电池中阴离子氧化还原的统一图

NATURE MATERIALS

IF38.5

2019-03-18385

OAAI

Synthesis and Electrochemical Activity of Some Na(Li)-Rich Ruthenium Oxides with the Feasibility to Stabilize Ru6+

具有稳定Ru6的可行性的某些富含Na(Li) 的钌氧化物的合成和电化学活性

ADVANCED ENERGY MATERIALS

IF26

2019-02-2729

PREAI

Competition between Metal Dissolution and Gas Release in Li-Rich Li3RuyIr1-yO4 Model Compounds Showing Anionic Redox

CHEMISTRY OF MATERIALS

IF7

2018-10-1926

OAAI

Anionic Redox Activity in a Newly Zn-Doped Sodium Layered Oxide P2-Na2/3Mn1-yZnyO2 (0 < y < 0.23)

新掺杂的钠层状氧化物P2-Na2/3Mn1-yZnyO2 (0 < y < 0.23) 中的阴离子氧化还原活性

ADVANCED ENERGY MATERIALS

IF26

2018-10-08206

OAAI

Atomic Structure of 2 nm Size Metallic Cobalt Prepared by Electrochemical Conversion: An in Situ Pair Distribution Function Study

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2018-10-0414

OAAI

Chemical Activity of the Peroxide/Oxide Redox Couple: Case Study of Ba5 Ru2O11 in Aqueous and Organic Solvents

过氧化物/氧化物氧化还原对的化学活性: 水和有机溶剂中Ba5 Ru2O11的案例研究

CHEMISTRY OF MATERIALS

IF7

2018-05-2110

OAAI

Modelling CO2 transfer in foil ripened semi-hard Swiss-type cheese

JOURNAL OF FOOD ENGINEERING

IF5.8

2018-04-012

OAAI