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January 1, 2025Digital DiscoveryOpen Access

Developing large language models for quantum chemistry simulation input generation

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PJPieter Floris JacobsRPRobert Pollice

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Jacobs et al. (2025) studied this question.

synapsesocial.com/papers/6a0eed511c5e2d2319fa1929https://doi.org/10.1039/d4dd00366g
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