Cloud native EDA tools & pre-optimized hardware platforms
We are very pleased to announce QuantumATK U-2022.12. The latest version of the QuantumATK atomic-scale modeling platform includes many new exciting features as well as performance improvements. We released a Service Pack QuantumATK U-2022.12-SP1 (bugfix update) on the 6th of March, 2023.
If you are a customer entitled to maintenance services, you can access QuantumATK U-2022.12-SP1 and download release notes directly from SolvNetPlus.
In this release, we have continued to develop our ML force field framework using Moment Tensor Potentials (MTPs). 1000-10,000x shorter computational time vs DFT enables ab initio accuracy for large system sizes and time scales greatly exceeding those accessible to DFT.
Updates to the Core MTP Framework
Pretrained MTP library
Multilayer Stack Generation using the Multilayer Builder GUI
A major new feature in this release is the inclusion of COSMO (COnductor-like Screening MOdel) to study solvation effects, as well as COSMO-RS to evaluate solubility and a range of other properties.
COSMO-RS is an extension of the COSMO model that uses the surface charges generated in the COSMO calculation to calculate the chemical potential of a molecule. GUI-features of the COSMO-RS Analyzer include:
The Workflow Builder (watch video) is a tool to set up complex workflows which can involve several separate simulations which are later used as input for various post-processing calculations. Here is a list of noteworthy features:
Surface Process Simulations
Polymer Simulations
Ion Dynamics
Force Fields
QuantumATK U-2022.12 Release Webinar
QuantumATK Previous Release Info
Request QuantumATK Product Evaluation
Interested in applying QuantumATK software to your research? Test our software or contact us at quantumatk@synopsys.com to get more information on QuantumATK platform for atomic-scale modeling.