Materials development simulation software compatible with various types of materials: 'Materials Studio'
"Materials Studio," a simulation software useful for new material development. By utilizing and collaborating with this tool, it contributes to more efficient and easier new material development. A next-generation molecular modeling/simulation toolset equipped with quantum mechanics, classical mechanics, mesoscale, statistics, and analysis/crystallization tools. 【Features】 ■ Simulation software that streamlines material development Available for use by those engaged in research, development, design, and manufacturing across various industries. ■ Supports various types of materials. ■ Allows for the creation of crystal structures, setting of calculation conditions, and display of calculation results all on a single GUI screen. 【Examples】 Tribochemical (lubrication) reactions Analysis of CFRP (carbon-based materials) Crystal growth, thin film formation, fuel cells, lubricants Catalysts, polymers, mixtures, metals and alloys, batteries, and fuel cells. "Materials Informatics" "An initiative to explore new materials through information science." In simple terms, "I want to create amazing materials easily!!" has become a realistic endeavor. *For more details, please feel free to contact us.
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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.
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Detailed information
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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.
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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, analytical, and crystallization tools.
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◆Diffusion of Oil in Water◆ This shows the calculation results of the diffusion of oil in water using dissipative particle dynamics. The dark reddish-brown mass in the center of the video is the oil. The green dots surrounding the oil are water molecules. In this calculation, four water molecules and one oil molecule are treated as a single bead (point particle) to speed up the computation time. ◇Used Modules Vizualizer, Mesocite
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◆Methane Diffusion in Polybutadiene Using Molecular Dynamics◆ Atomic distances and molecular angles can be easily determined using the Amorphous Cell to ensure that the atomic distances are not too close, based on the force fields used in molecular dynamics. For the polymer polybutadiene, it is also possible to obtain complex atomic arrangements based on force field calculations while considering density. ◇Used Modules Visualizer, Amorphous Cell, Forcite Plus, COMPASS
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◆Behavior of Silane Coupling on CeO2(110) Surface◆ This is the result of calculations on the behavior of silane coupling on the CeO2(110) surface using molecular dynamics simulations. By using the COMPASS force field, which has been rigorously validated, it is possible to accurately calculate the behavior of organic molecules. ◇Modules Used Vizualizer, Forcite Plus, COMPASS
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Simulation of tribochemical reactions A friction phenomenon involving chemical reactions of amorphous SiC using water as a lubricant Simulation of tribochemical reactions
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Image of "Dissolution Parameters of Mixed Polymers" analysis using [Forcite Plus].
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Analysis image of "physical property calculation of CFRP, which is one of the composite materials, using [Forcite Plus]."
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![[Case Study] Ideal for Lithium-Ion Battery Material Development - Free Case Study Available for 'Materials Studio'!](https://image.www.ipros.com/public/catalog/image/01/853/582890/IPROS44299245369553055023.jpeg?w=120&h=170)
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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.
