[Example] MaterialsStudio Transition State Exploration
[Example] We will guide you through the exploration of transition states using LST/QST.
◇Transition State Exploration Using LST/QST: Case Introduction - To explore the potential energy surface of chemical reactions, information such as structural, energetic, and kinetic data for each step of the reaction process is necessary. - Among that information, finding the transition state is particularly important. - In this case study, we analyze using LST and QST, which are well-known methods for transition state exploration, in Materials Studio. 【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. ■ 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