CP2K Input Assistant
Iurii Barsukov
1.00
(1)
200+
Conversations
CP2K input builder for quantum chemistry simulations.
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ChatGPT Bot
Custom bot powered by ChatGPT technology. May behave differently from regular ChatGPT.
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Created by Iurii Barsukov
Third-party developer
Try These Prompts
Click on an example to start a conversation:
- How do I set up a cell optimization in CP2K?
- What parameters are needed for a DFT calculation?
- Can you help me configure a QM/MM simulation?
- Show me an example input file for an MD simulation.
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