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🔢 sto-ns - Efficient Math for Quantum Chemistry

🚀 Getting Started

Welcome to the sto-ns project. This software provides a powerful toolbox for evaluating two-center Coulomb integrals easily. With its lightweight design, it serves both semi-empirical methods and ab initio calculations without unnecessary complexity.

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📜 Overview

The sto-ns application is a pure Rust mathematical kernel focused on performing exact evaluations of two-center Coulomb integrals over Slater-type orbitals. It has been crafted with a zero-allocation approach, making it memory-efficient while maintaining high performance in scientific computing tasks.

✨ Key Features

• No-Std Library: Works without a standard library, allowing it to run on various embedded systems.
• Pure Rust Implementation: Ensures safety and reliability in mathematical computations.
• Zero Allocation: Reduces runtime memory spikes which can lead to performance issues.

💻 System Requirements

• Operating System: Works on Windows, macOS, and Linux.
• Rust Version: Requires Rust 1.51 or later.
• Memory: Minimum of 128 MB RAM is recommended for optimal performance.

🔧 Usage

To use the sto-ns software, follow these steps:

Step 1: Download the Software

Visit this page to download the latest version of sto-ns: Download sto-ns.

Step 2: Extract Files

Once downloaded, locate the ZIP file in your Downloads folder. Right-click the file and select “Extract All” to unzip the contents to a desired location on your system.

Step 3: Run the Application

After extraction, navigate to the folder where the files are located. Locate the executable file for your operating system and double-click to run it.

If prompted with security warnings, you can proceed as this software is safe to use. Ensure your system’s antivirus settings allow running applications from friends or external sources.

Step 4: Configuration

You can configure the software settings within the application interface. Set the desired parameters for your calculations, such as orbital types, and other numerical values.

Step 5: Execute Calculations

Simply enter the required data as specified in the user interface and click “Run”. The results will display in the application, allowing you to proceed with your computations seamlessly.

📊 Documentation

Full documentation is available to help you better understand the features and capabilities of sto-ns. It includes detailed guides, examples, and explanations on how to leverage its mathematical tools for your projects.

🌐 Community Support

Join our community for user discussions and support. You can connect via:

• GitHub Issues: Report bugs or request features.
• Discussion Forums: Join conversations with other users.
• Email: Reach out for direct support.

🔗 Additional Resources

For further reading, check out the following topics that are connected with sto-ns:

• Quantum Chemistry: Learn more about theoretical concepts and applications.
• Mathematics: Explore the foundational principles driving our calculations.
• Rust Programming: Familiarize yourself with the Rust language to customize your experience further.

🛠️ Download & Install

To start using sto-ns, visit this page to download the latest version: Download sto-ns.

Following these steps ensures you have everything you need to run the software smoothly. If you encounter any issues, consult the community or the documentation for answers. Enjoy your experience with sto-ns!