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Synopsys QuantumATK - U-2022.12 Release Now Avai ... (No replies)

QuantumATK
2 years ago
QuantumATK 2 years ago

We are pleased to announce QuantumATK U-2022.12, with the latest version of our atomic-scale modeling platform including many new features and performance improvements. 

Highlights of the U-2022.12 release include:

Machine-Learned Force Fields for Realistic Structures and Thermal Properties

Defect-Assisted Recombination from DFT Calculations

Modeling of Homogeneous Electric Fields in DFT

Atomistic Spin Dynamics - Integration with Vampire

COSMO and COSMO-RS

R2SCAN Exchange-Correlation Functional

PAW method for LCAO

New Workflow Builder for Setting Up Simple and Complex Calculation Workflows

Updates Related to Molecular Dynamics and Force Fields

Various GUI & Platform Updates

Read more about these updates at: https://www.synopsys.com/silicon/quantumatk/resources/release-notes.html

If you are a customer entitled to maintenance services, you can download the U-2022.12 installers, new license keys, and full release notes directly from SolvNet Plus.




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Ab initio (from electronic structure) calculation of complex processes in materials