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Variational free complement method with Gaussian-expanded complement functions: convergence with fixed Gaussian expansion length

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Physics > Chemical Physics [Submitted on 1 Jun 2026] Title:Variational free complement method with Gaussian-expanded complement functions: convergence with fixed Gaussian expansion length View PDF HTML (experimental)Abstract:For the free complement theory with Gaussian-expanded complement functions, the energy convergence of $n_\mathrm{G} = \mathrm{constant} < \infty, n\rightarrow\infty$ is discussed, where $n_\mathrm{G}$ is the number of the Gaussian functions in the STO-$n$G expansion.

Physics > Chemical Physics [Submitted on 1 Jun 2026] Title:Variational free complement method with Gaussian-expanded complement functions: convergence with fixed Gaussian expansion length View PDF HTML (experimental)Abstract:For the free complement theory with Gaussian-expanded complement functions, the energy convergence of $n_\mathrm{G} = \mathrm{constant} < \infty, n\rightarrow\infty$ is discussed, where $n_\mathrm{G}$ is the number of the Gaussian functions in the STO-$n$G expansion. Current browse context: physics.chem-ph Change to browse by: References & Citations Loading... Bibliographic and Citation Tools Bibliographic Explorer (What is the Explorer?) Connected Papers (What is Connected Papers?) Litmaps (What is Litmaps?) scite Smart Citations (What are Smart Citations?) Code, Data and Media Associated with this Article alphaXiv (What is alphaXiv?) CatalyzeX Code Finder for Papers (What is CatalyzeX?) DagsHub (What is DagsHub?) Gotit.pub (What is GotitPub?) Hugging Face (What is Huggingface?) ScienceCast (What is ScienceCast?) Demos Recommenders and Search Tools Influence Flower (What are Influence Flowers?) CORE Recommender (What is CORE?) arXivLabs: experimental projects with community collaborators arXivLabs is a framework that allows collaborators to develop and share new arXiv features directly on our website. Both individuals and organizations that work with arXivLabs have embraced and accepted our values of openness, community, excellence, and user data privacy. arXiv is committed to these values and only works with partners that adhere to them. Have an idea for a project that will add value for arXiv's community? Learn more about arXivLabs.
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