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  6. [Example] Polymer/Metal Surface Interaction in MaterialsStudio

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『Materials Studio』

last updated:Apr 16, 2021

ウェーブフロント 本社
ウェーブフロント 本社
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Introduction of interaction examples between "polymer/metal surfaces" in Materials Studio.

Case Study Utilizing "Materials Studio" ◇ The interaction at interfaces in polymers is important in a wide range of products. For example, adhesives, coatings, composite materials, films, lubricants, paints, and printing inks. The properties at interfaces are of interest to researchers in these fields. Utilizing one of the modules, "Forcite Plus," helps to understand the structure of interfaces. In this case study, we simulated the interaction between alumina (Al2O3) and polyparanitrostyrene. 【Features】 ■ Also optimal for "Materials Informatics" ■ Simulation software that streamlines material development It can be used by those engaged in research, development, design, and manufacturing across various industries. ■ Helps in the development of new materials more efficiently and easily. ■ Supports various types of materials. ■ Allows for the creation of crystal structures, setting calculation conditions, and displaying calculation results all on a single GUI screen. *For more details, please feel free to contact us. Wavefront Corporation Sales Department MAIL: sales@wavefront.co.jp

    Scientific Calculation and Simulation SoftwareOther Softwareothers
image004.1.png

[Example] Polymer/Metal Surface Interaction in MaterialsStudio

image004.1.png
image004.1.png
  • Related Link - https://www.wavefront.co.jp/CAE/BIOVIA/Materials%2…

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【Tools】 ■ Quantum Mechanics Simulation Tool ■ Classical Simulation Tool ■ Mesoscale Simulation Tool ■ Statistical Tool ■ Analysis/Crystallization Tool 【Examples】 ・Crystal Growth ・Behavior of Atoms on Crystal Surfaces ・Crystal Analysis ・Calculation of Physical Properties ・Sputtering Simulation ・Improvement of Lubricant Performance ・Catalysts ・Tribochemical (Lubrication) Reactions    etc. *For more details, please feel free to contact us. Wavefront Corporation Sales Department MAIL: sales@wavefront.co.jp URL: http://www.wavefront.co.jp/

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  • マテスタ_掲載用画像.png

    Materials Studio provides a graphical user environment called Materials Studio Visualizer, which can be used to create, manipulate, and display models of molecules, crystals, surfaces, polymers, and mesoscale structures.

  • 図1.jpg

    Multiscale Simulation of Materials 'Materials Studio' is a comprehensive modeling/simulation platform equipped with: - Quantum mechanics (Density Functional Theory) - Classical mechanics (Molecular Dynamics Calculations) - Mesoscale (Dissipative Particle Dynamics Calculations, etc.) along with statistical, analysis, and crystallization tools.

  • image004.1.png

    I will show the model of the initial structure.

  • image004.2.png

    Here is the data sheet of the calculation results.

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Materials Development Integrated Simulation Software "Materials Studio"

Materials Development Integrated Simulation Software "Materials Studio"

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Essential for material manufacturers! Electronic lab notebook 'BIOVIA Notebook'

Essential for material manufacturers! Electronic lab notebook 'BIOVIA Notebook'

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Data Analysis Comprehensive Platform (Data Science Tool) 'PipelinePilot'

Data Analysis Comprehensive Platform (Data Science Tool) 'PipelinePilot'

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[Case Study] Ideal for Lithium-Ion Battery Material Development - Free Case Study Available for 'Materials Studio'!

[Case Study] Ideal for Lithium-Ion Battery Material Development - Free Case Study Available for 'Materials Studio'!

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Easy introduction to the electronic lab notebook 'BIOVIA Notebook'

Easy introduction to the electronic lab notebook 'BIOVIA Notebook'

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Our company develops and sells a "Maintenance Management System" for managing and operating various plants, factories, and other facilities and assets. Currently, this system is undergoing significant evolution into a system that incorporates IoT technologies, such as sensor information and input from tablet devices, as well as AI technologies like machine learning, featuring functions for failure prediction and automatic scheduling. Additionally, as part of the recent trend of digital transformation (DX), there is a growing movement to digitize and automate manufacturing processes and research and development sites in factories to improve operational efficiency. In line with this trend, our company provides a solution aimed at enhancing efficiency in research and development environments, which is the Laboratory Information Management System (LIMS). This software includes features such as workflow management, data tracking, data management, data analysis, and integration of electronic lab notebooks.

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