Simulation Software(Materials) - List of Manufacturers, Suppliers, Companies and Products

[Example] Materials Studio - Prediction of Physical Properties of Organic Molecules

[Case Study] Materials Studio: Application of Machine Learning to Organic Molecules - A Case Study of Applying Materials Informatics to Predict the Properties of Organic Molecules.

◇Application of Materials Studio and Material Informatics (MI) to the prediction of physical properties of organic molecules - This presentation introduces a case study utilizing the "Materials Studio" and "Pipeline Pilot" tools to estimate the lipophilicity and hydrophilicity of organic molecules. 【Product Features】 ■ Also optimal for "Materials Informatics" ■ Simulation software that streamlines material development Available for use by those engaged in research, development, design, and manufacturing across various industries ■ Helps in the development of new materials more efficiently and easily. ■ Compatible with various types of materials ■ All tasks, including crystal structure creation, calculation condition settings, and display of calculation results, can be performed on a single GUI screen. *For more details, please feel free to contact us. Wavefront Corporation Sales Department MAIL: sales@wavefront.co.jp

Company：ウェーブフロント本社
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[Example] Materials Studio Y Additive Properties

[Example] Introducing the properties of Y-doped ZnO monolayers in semiconductor devices using Materials Studio.

◇Materials Studio Semiconductor Device Y Additive ZnO Monolayer Characteristics Case Study - As a semiconductor-based technology, applications for semiconductor devices such as transistors and diodes, as well as photocatalysts, are gaining attention. - We will introduce a case study utilizing "Materials Studio" for semiconductor-based photocatalysts. 【Product Features】 ■ Also optimal for "Materials Informatics" ■ Simulation software that streamlines material development Available for use 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 ■ All tasks, including crystal structure creation, calculation condition settings, and calculation result display, can be performed on a single GUI screen *For more details, please feel free to contact us. Wavefront Corporation Sales Department MAIL: sales@wavefront.co.jp

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[Example] STM Simulation of MaterialsStudio

Introduction of STM image simulation examples of CO on Pd in "Materials Studio".

Case Study Utilizing "Materials Studio" ◇ Example of "STM Simulation of CO on Pd" - The STM simulation can easily distinguish the differences of CO adsorbed on Pd. - The shape of the STM image suggests that the contrast is mainly due to the π orbitals of the CO molecules. - The colors correspond to the total density of states, with the white areas corresponding to the highest density of states (DOS). ◇ By utilizing "Materials Studio," it contributes to more efficient and easier development of new materials. ■ Also optimal for "Materials Informatics" 【Features】 ■ Simulation software that streamlines material development Available for use by those engaged in research, development, design, and manufacturing across various industries. ■ Compatible with various types of materials ■ All processes including crystal structure creation, calculation condition settings, and calculation result display can be performed on a single GUI screen. *For more details, please feel free to contact us. Wavefront Co., Ltd. Sales Department MAIL: sales@wavefront.co.jp

Company：ウェーブフロント本社
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Semiconductor Material Development Analysis Software 'Materials Studio'

Effective materials development simulation software for "Materials Informatics" - 'Materials Studio'

By utilizing tools and collaborating, we can contribute to new material development more efficiently and easily. ■ Ideal for "Materials Informatics" This is a group of molecular modeling/simulation tools for next-generation material development equipped with quantum mechanics, classical mechanics, mesoscale, statistics, and analysis/crystallization tools. 【Features】 ■ Simulation software that streamlines material development It can be used by those engaged in research, development, design, and manufacturing across various industries. ■ Supports various types of materials ■ All tasks, including crystal structure creation, calculation condition settings, and calculation result display, can be performed 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, etc. *For more details, please feel free to contact us. Wavefront Co., Ltd. Sales Department MAIL: sales@wavefront.co.jp URL: http://www.wavefront.co.jp/

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[Example] Aggregation of gold nanoparticles in aqueous solvent using MaterialsStudio.

Introduction to the aggregation of gold nanoparticles in aqueous solvent using Materials Studio.

Case Study Utilizing "Materials Studio" ◇Metal nanoparticles, which are nanosized metal particles, are attracting attention due to their unique properties. A typical example is surface plasmon resonance, which is the basis for the vibrant colors seen in stained glass and other materials. However, since this characteristic is exclusive to nanosized particles, it is necessary to prevent particle aggregation. Forcite Plus, a module of Materials Studio, helps observe particle behavior in such cases. 【Product Features】 ■ Ideal 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. ■ Compatible with 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. *For more details, please feel free to contact us. Wavefront Corporation Sales Department MAIL: sales@wavefront.co.jp

Company：ウェーブフロント本社
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[Example] Tensile test of resin and copper interface in MaterialsStudio

Introduction of tensile test case for resin and copper interface in Materials Studio.

Case Study Utilizing "Materials Studio" ◇ It is possible to observe the movement of molecules during tensile testing. It is possible to determine the force required to lift epoxy resin with a crosslink density. Additionally, it is possible to determine the crosslinked structure in an amorphous state. 【Product Features】 ■ Ideal for "Materials Informatics" ■ Simulation software that streamlines material development Available for use 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. ■ All tasks, including crystal structure creation, calculation condition settings, and calculation result display, can be performed on a single GUI screen. *For more details, please feel free to contact us. Wavefront Co., Ltd. Sales Department MAIL: sales@wavefront.co.jp

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[Case Study] Li Ion Diffusion Energy on Graphite Anode

"Materials Studio" can perform battery property calculations [Case Study] Here we introduce a paper case.

By profiling the diffusion energy of ions within the holy graphite, we are conducting discussions on the effects of the holy structure using Materials Studio. ◇ The effects associated with the improvement treatment of graphite anodes can be confirmed. 【Product Features】 ■ Also optimal for "Materials Informatics (MI)" ■ Simulation software that streamlines material development ■ Helps in the development of new materials more efficiently and easily. *For more details, please feel free to contact us.

Company：ウェーブフロント本社
Price：Other

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[Example] Optical property calculation of coumarin using MaterialsStudio

Introduction of a simulation case for calculating the optical properties of coumarin using Materials Studio.

Case Study Utilizing "Materials Studio" ◇ Coumarin molecules are a type of aromatic compound derived from plants, represented by cherry leaves. Additionally, it is known that coumarin molecules are optically active. By utilizing one of the modules, "DMOL3," we can gain insights into optical properties in such cases. In this case study, we simulated the optical properties of coumarin molecules in both vacuum and aqueous solvent. Furthermore, the consideration of the solvent was conducted using the COSMO solvent model. 【Features】 ■ Also optimal for "Materials Informatics" ■ Simulation software that streamlines material development Available for use 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 of calculation conditions, and display of 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

Company：ウェーブフロント本社
Price：Other

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[Example] Polymer/Metal Surface Interactions in MaterialsStudio

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 product fields. 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. ■ All tasks, including crystal structure creation, calculation condition setting, and calculation result display, can be performed on a single GUI screen. *For more details, please feel free to contact us. Wavefront Co., Ltd. Sales Department MAIL: sales@wavefront.co.jp

Company：ウェーブフロント本社
Price：Other

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Simulation Software(Materials) - List of Manufacturers, Suppliers, Companies and Products

Simulation Software Product List