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C

Caroline Desgranges

University of Massachusetts
H指数:27
被引数:2,010
浏览量:0

个人简介

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荣誉奖项

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Rapid Exploration of Mixture Adsorption via Adiabatic Sampling

通过绝热采样快速探索混合物吸附

The Journal of Physical Chemistry C
IF3.2
2026-06-170
OA
Caroline Desgranges; Jerome Delhommelle
Programming entropy production hotspots via interaction patterning

通过相互作用模式编程熵产生热点

Soft Matter
IF2.8
2026-04-170
PRE
Caroline Desgranges; Jerome Delhommelle
Mini Review: Synergizing Driven Quantum Dynamics; AI; and Quantum Computing for Next-Gen Materials Science

微型综述：协同驱动的量子动力学；人工智能；和量子计算用于下一代材料科学

The Journal of Physical Chemistry Letters
IF0
2025-11-050
OAAI
Opeyemi S. Akanbi; Jack P. Shannon; Jerome Delhommelle; Caroline Desgranges
Mapping Local Dissipation and Entropy Production in Complex and Active Fluids

映射复杂流体和活性流体中的局部耗散与熵产生

The Journal of Physical Chemistry Letters
IF0
2025-10-240
OA
Caroline Desgranges; Jerome Delhommelle
Deciphering the complexities of crystalline state(s) with molecular simulations

通过分子模拟解析晶态（s）的复杂性

Communications Chemistry
IF6.2
2025-09-260
OAAI
Caroline Desgranges; Jerome Delhommelle
Accelerated convergence via adiabatic sampling for adsorption and desorption processes
JOURNAL OF CHEMICAL PHYSICS
IF3.1
2024-09-090
PRE
Desgranges, Caroline; Delhommelle, Jerome
Designing, synthesizing, and modeling active fluids
PHYSICS OF FLUIDS
IF4.3
2022-07-1511
OA
Essafri, Ilham; Ghosh, Bappa; Desgranges, Caroline; Delhommelle, Jerome
Entropy determination for mixtures in the adiabatic grand-isobaric ensemble
JOURNAL OF CHEMICAL PHYSICS
IF3.1
2022-02-233
OA
Desgranges, Caroline; Delhommelle, Jerome
Towards a machine learned thermodynamics: exploration of free energy landscapes in molecular fluids, biological systems and for gas storage and separation in metal-organic frameworks
MOLECULAR SYSTEMS DESIGN & ENGINEERING
IF3.2
2021-01-0110
PREAI
Desgranges, Caroline; Delhommelle, Jerome
Entropy production in model colloidal suspensions under shear via the fluctuation theorem
JOURNAL OF CHEMICAL PHYSICS
IF3.1
2020-12-091
OAAI
Desgranges, Caroline; Delhommelle, Jerome
The central role of entropy in adiabatic ensembles and its application to phase transitions in the grand-isobaric adiabatic ensemble
JOURNAL OF CHEMICAL PHYSICS
IF3.1
2020-09-045
OAAI
Desgranges, Caroline; Delhommelle, Jerome
Unraveling liquid polymorphism in silicon driven out-of-equilibrium
JOURNAL OF CHEMICAL PHYSICS
IF3.1
2020-08-035
OAAI
Desgranges, Caroline; Delhommelle, Jerome
Ensemble Learning of Partition Functions for the Prediction of Thermodynamic Properties of Adsorption in Metal-Organic and Covalent Organic Frameworks
JOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
2019-12-3115
PREAI
Desgranges, Caroline; Delhommelle, Jerome
Nucleation of Capillary Bridges and Bubbles in Nanoconfined CO2
LANGMUIR
IF3.9
2019-11-0110
PREAI
Desgranges, Caroline; Delhommelle, Jerome
Stabilization of Nanobubbles under Hydrophobic Confinement
JOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
2019-04-1710
OAAI
Desgranges, Caroline; Delhommelle, Jerome
Communication: Existence and control of liquid polymorphism in methanol under shear
JOURNAL OF CHEMICAL PHYSICS
IF3.1
2018-09-199
OAAI
Desgranges, Caroline; Delhommelle, Jerome
A new approach for the prediction of partition functions using machine learning techniques
JOURNAL OF CHEMICAL PHYSICS
IF3.1
2018-07-2719
PREAI
Desgranges, Caroline; Delhommelle, Jerome
Prediction of the phase equilibria for island-type asphaltenes via HMC-WL simulations
JOURNAL OF CHEMICAL PHYSICS
IF3.1
2018-05-183
PREAI
Desgranges, Caroline; Delhommelle, Jerome
Modeling antigen-antibody nanoparticle bioconjugates and their polymorphs
JOURNAL OF CHEMICAL PHYSICS
IF3.1
2018-03-272
PREAI
Desgranges, Caroline; Delhommelle, Jerome
Selectivity and Desorption Free Energies for Methane-Ethane Mixtures in Covalent Organic Frameworks
JOURNAL OF PHYSICAL CHEMISTRY C
IF3.2
2017-10-3111
PREAI
Gopalsamy, K.; Desgranges, Caroline; Delhommellee, Jerome

研究方向

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J
Jérôme Delhommelle
H 指数:34论文数:179被引数:4,145
B
Bappa Ghosh
H 指数:5论文数:9被引数:77
J
Jason M. Hicks
H 指数:3论文数:7被引数:65
O
O. Akanbi
H 指数:3论文数:9被引数:81
I
Ilham Essafri
H 指数:6论文数:25被引数:169
K
Karuppasamy Gopalsamy
H 指数:13论文数:38被引数:438
K
K. Ndumbe Ngale
H 指数:3论文数:4被引数:46
J
Jack P. Shannon
H 指数:0论文数:2被引数:0