Multiscale Modeling

Computational chemistry from quantum chemistry to thermodynamics simulation

Multiscale Computational Chemistry Software Simcenter Culgi

To enable materials innovation in today’s face-paced environment, access to a computational chemistry software covering the entire hierarchy of material scales is essential. Simcenter uniquely includes all relevant aspects of computational chemistry: from quantum to molecular and coarse-grained modeling, to informatics and thermodynamics. 

It enables realistic models for simulations through scripted workflows that facilitate a data flow of parameters from quantum models all the way to the continuum level. This, combined with a comprehensive computational library, ensures that physical parameters are derived with great accuracy and enables materials innovation across all length and time scales.

 

Multiscale Modeling

To enable materials innovation in today’s face-paced environment, access to a computational chemistry software covering the entire hierarchy of material scales is essential. Simcenter uniquely includes all relevant aspects of computational chemistry: from quantum to molecular and coarse-grained modeling, to informatics and thermodynamics. 

It enables realistic models for simulations through scripted workflows that facilitate a data flow of parameters from quantum models all the way to the continuum level. This, combined with a comprehensive computational library, ensures that physical parameters are derived with great accuracy and enables materials innovation across all length and time scales.

 

Simcenter Culgi

Simcenter Culgi helps product development and material scientists to design new materials with the desired properties along the complete life cycle from inception, to process development, logistics, and market analysis on a digital platform.

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