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Theoretical and Computational Chemistry

Working Paper

Machine Learning for Accurate Force Calculations in Molecular Dynamics Simulations

Punyaslok Pattnaik, Shampa Raghunathan, Tarun Kalluri, Prabhakar Bhimalapuram, C. V. Jawahar, U. Deva Priyakumar

Version 1 posted 08 May 2020

1,145

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Analytical Chemistry

Working Paper

Microstructure determines water and salt permeation in commercial ion exchange membranes

Ryan Kingsbury, Shan Zhu, Sophie Flotron, Orlando Coronell

Version 4 posted 15 October 2018

1,505

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Analytical Chemistry

Working Paper

Elucidating Charge Transfer Processes and Enhancing Electrochemical Performance of Laser-Induced Graphene via Surface Engineering with Sustainable Hydrogel Membranes: An Electrochemist's Perspective

Mohsen Khodadadiyazdi, Aiswarya Manohar, Adrian Olejnik, Agata Smułka, Agnieszka Kramek, Mattia Pierpaoli, Mohammad Reza Saeb, Robert Bogdanowicz, Jacek Ryl

Version 1 posted 26 April 2024

179

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Analytical Chemistry

Review

Mass Diffusivity Measurements Using Interferometry

Sarthak Patnaik

Version 1 posted 23 January 2024

104

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Theoretical and Computational Chemistry

Working Paper

Effect of Particle Size and Alloying with Gallium and Zinc in Copper Nanoparticles from Ab Initio Molecular Dynamics

Andreas Müller, Aleix Comas-Vives, Christophe Copéret

Version 1 posted 27 August 2024

154

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Analytical Chemistry

Working Paper

Fluorescent Nanodiamonds Encapsulated by Cowpea Chlorotic Mottle Virus (CCMV) Proteins for Intracellular 3D-Trajectory Analysis

Yingke Wu, Shuqin Cao, Md Noor A Alam, Marco Raabe, Sandra Michel-Souzy, Zuyuan Wang, Manfred Wagner, Anna Ermakova, Jeroen J. L. M. Cornelissen, Tanja Weil

Version 1 posted 15 April 2021

347

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Energy

Working Paper

A fast alternative to the galvanostatic intermittent titration technique

Yu-Chuan Chien, Haidong Liu, Ashok S. Menon, William R. Brant, Daniel Brandell, Matthew J. Lacey

Version 1 posted 22 June 2021

1,871

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Refine Search

7 results in diffusion coefficient in Keywords: diffusion coefficient

Machine Learning for Accurate Force Calculations in Molecular Dynamics Simulations

Microstructure determines water and salt permeation in commercial ion exchange membranes

Elucidating Charge Transfer Processes and Enhancing Electrochemical Performance of Laser-Induced Graphene via Surface Engineering with Sustainable Hydrogel Membranes: An Electrochemist's Perspective

Mass Diffusivity Measurements Using Interferometry

Effect of Particle Size and Alloying with Gallium and Zinc in Copper Nanoparticles from Ab Initio Molecular Dynamics

Fluorescent Nanodiamonds Encapsulated by Cowpea Chlorotic Mottle Virus (CCMV) Proteins for Intracellular 3D-Trajectory Analysis

A fast alternative to the galvanostatic intermittent titration technique

7 results in Keywords: diffusion coefficient