Isabelle Baraille - Publications, H-index & Citations

Isabelle Baraille

centre national de la recherche scientifique (cnrs)

24H指数

93论文数

2.5K被引数

收录论文 37

发表时间

Cancellation of dipole moment of models of asphaltene aggregates as a mean for their dispersion in toluene and THF calculated using molecular dynamics 消除沥青质聚集体模型的偶极矩，作为使用分子动力学计算其在甲苯和THF中分散的平均值

FUEL

IF7.5

2023-02-01

OAAI

Villegas, Orlando; Vallverdu, Germain Salvato; Bouyssiere, Brice; Acevedo, Socrates; Castillo, Jimmy; Baraille, Isabelle

Relating the Electrochemical Behavior of Birnessite to the Morphology and Specific Surface: Interest of Studying the Surface Reactivity

ACS APPLIED ENERGY MATERIALS

IF5.5

2022-10-14

OAAI

Lemoine, Alexia; Invernizzi, Ronan; Vallverdu, Germain Salvato; Olchowka, Jacob; Guerlou-Demourgues, Liliane; Baraille, Isabelle; Flahaut, Delphine

Controlled Nanostructuration of Cobalt Oxyhydroxide Electrode Material for Hybrid Supercapacitors 混合超级电容器羟基氧化钴电极材料的可控纳米结构

MATERIALS

IF3.2

2021-04-29

OAAI

Invernizzi, Ronan; Guerlou-Demourgues, Liliane; Weill, Francois; Lemoine, Alexia; Dourges, Marie-Anne; Baraille, Isabelle; Flahaut, Delphine; Olchowka, Jacob

Surface Reactivity and Surface Characterization of the Layered β(III)-CoOOH Material: an Experimental and Computational Study

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2021-04-15

OAAI

Lemoine, Alexia; Invernizzi, Ronan; Vallverdu, Germain Salvato; Madec, Lenaic; Olchowka, Jacob; Guerlou-Demourgues, Liliane; Baraille, Isabelle; Flahaut, Delphine

Surface reactivity of Li2MnO3: Structural and morphological impact

APPLIED SURFACE SCIENCE

IF6.9

2021-03-01

OAAI

Quesne-Turin, Ambroise; Flahaut, Delphine; Vallverdu, Germain Salvato; Croguennec, Laurence; Allouche, Joachim; Weill, Francois; Menetrier, Michel; Baraille, Isabelle

Stabilization and Improvement of Energy Storage Performance of High Mass Loading Cobalt Hydroxide Electrode by Surface Functionalization

JOURNAL OF THE ELECTROCHEMICAL SOCIETY

IF3.3

2020-06-15

OAAI

Olchowka, Jacob; Invernizzi, Ronan; Lemoine, Alexia; Allouche, Joachim; Baraille, Isabelle; Flahaut, Delphine; Guerlou-Demourgues, Liliane

Role of the porphyrins and demulsifiers in the aggregation process of asphaltenes at water/oil interfaces under desalting conditions: a molecular dynamics study 脱盐条件下卟啉和破乳剂在水/油界面沥青质聚集过程中的作用: 分子动力学研究

PETROLEUM SCIENCE

IF6.1

2020-02-05

OAAI

Silva, H. Santos; Alfarra, A.; Vallverdu, G.; Begue, D.; Bouyssiere, B.; Baraille, I

Asphaltene aggregation studied by molecular dynamics simulations: role of the molecular architecture and solvents on the supramolecular or colloidal behavior 通过分子动力学模拟研究沥青质聚集: 分子结构和溶剂对超分子或胶体行为的作用

PETROLEUM SCIENCE

IF6.1

2019-05-03

OAAI

Silva, H. Santos; Alfarra, A.; Vallverdu, G.; Begue, D.; Bouyssiere, B.; Baraille, I.

Morphology and Surface Reactivity Relationship in the Li1+xMn2-xO4 Spinel with x=0.05 and 0.10: A Combined First -Principle and Experimental Study x = 0.05和0.10的Li1 xMn2-xO4尖晶石的形态和表面反应性关系: 结合第一性原理和实验研究

ACS APPLIED MATERIALS & INTERFACES

IF8.2

2017-12-15

OAAI

Quesne-Turin, Ambroise; Vallverdu, Germain; Flahaut, Delphine; Allouche, Joachim; Croguennec, Laurence; Menetrier, Michel; Baraille, Isabelle

Surface Reactivity of Li2MnO3: First-Principles and Experimental Study Li2MnO3的表面反应性: 第一性原理和实验研究

ACS APPLIED MATERIALS & INTERFACES

IF8.2

2017-12-11

OAAI

Quesne-Turin, Ambroise; Flahaut, Delphine; Croguennec, Laurence; Vallverdu, Germain; Allouche, Joachim; Charles-Blin, Youn; Chotard, Jean-Noel; Menetrier, Michel; Baraille, Isabelle

A-VCI: A flexible method to efficiently compute vibrational spectra

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2017-06-05

OAAI

Odunlami, Marc; Le Bris, Vincent; Begue, Didier; Baraille, Isabelle; Coulaud, Olivier

The role of metalloporphyrins on the physical-chemical properties of petroleum fluids

FUEL

IF7.5

2017-01-01

OAAI

Silva, Hugo Santos; Sodero, Ana C. R.; Korb, Jean-Pierre; Alfarra, Ahmad; Giusti, Pierre; Vallverdu, Germain; Begue, Didier; Baraille, Isabelle; Bouyssiere, Brice

First principle study of the surface reactivity of layered lithium oxides LiMO2 (M = Ni, Mn, Co)层状锂氧化物lim02 (M = Ni，Mn，Co) 表面反应性的第一性原理研究

SURFACE SCIENCE

IF1.8

2016-07-01

PREAI

Vallverdu, Germain; Minvielle, Marie; Andreu, Nathalie; Gonbeau, Danielle; Baraille, Isabelle

Adaptive vibrational configuration interaction (A-VCI): A posteriori error estimation to efficiently compute anharmonic IR spectra

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2016-05-31

OAAI

Garnier, Romain; Odunlami, Marc; Le Bris, Vincent; Begue, Didier; Baraille, Isabelle; Coulaud, Olivier