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ELSI software: Interfaces designed for DFT codes to connect with ELPA, libOMM, PEXSI, CheSS, SIPs libraries. Please note that this is a mirror of https://git.elsi-interchange.org/elsi-devel/elsi-interface.
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Library of exchange-correlation functionals for density-functional theory. Please note that this is a mirror of https://gitlab.com/libxc/libxc.
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Library implementing the orbital minimization method for solving the Kohn-Sham equation as a generalized eigenvalue problem. Please note that this is a mirror of https://gitlab.com/ElectronicStructureLibrary/omm-bundle.
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The E-CAM Library is a collection of software, applications and tools relevant to the target research community of E-CAM.
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The E-CAM Library is a collection of software, applications and tools relevant to the target research community of E-CAM.
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EF analysis tool, durham ecam
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Additional examples from E-CAM modules that have been incorporated into OpenPathSampling.
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Repository for creating the transition state ensemble module for OpenPathSampling
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The E-CAM Library is a collection of software, applications and tools relevant to the target research community of E-CAM.
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The E-CAM Library is a collection of software, applications and tools relevant to the target research community of E-CAM.
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The E-CAM Library is a collection of software, applications and tools relevant to the target research community of E-CAM.
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The E-CAM Library is a collection of software, applications and tools relevant to the target research community of E-CAM.
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The E-CAM Library is a collection of software, applications and tools relevant to the target research community of E-CAM.
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The E-CAM Library is a collection of software, applications and tools relevant to the target research community of E-CAM.
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The E-CAM Library is a collection of software, applications and tools relevant to the target research community of E-CAM.
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The E-CAM Library is a collection of software, applications and tools relevant to the target research community of E-CAM.
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The E-CAM Library is a collection of software, applications and tools relevant to the target research community of E-CAM.
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Introductory tutorial on TPS, committor analysis, and (MS)TIS with OpenPathSampling
