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Optimization of Plasticizer Properties | QuantistryLab Viscosity Simulations

Organic Chemistry

Optimization of Plasticizer Properties | QuantistryLab Viscosity Simulations

October 28, 2024

Plasticizers are essential additives that enhance the flexibility, durability, and processability of materials, making them widely used in industries ranging from construction to medical devices. Among their key plasticizer properties, viscosity plays a crucial role in determining plasticizer efficiency. However, traditional R&D methods for optimizing PVC plasticizers are time-consuming and costly.

This use case demonstrates how QuantistryLab leverages molecular dynamics to perform viscosity simulations of acetyl tributyl citrate (ATBC), a widely used PVC plasticizer. By predicting viscosity at specific temperature and pressure conditions, chemical simulations provide an accurate, efficient alternative to experimental testing, accelerating the development of next-generation plasticizers.

How can QuantistryLab's viscosity prediction streamline plasticizer formulation and drive innovation in sustainable chemicals?

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