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hartree-fock
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docs: add Quickstep getting-started material (#5100)
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2026-04-26 12:02:00 +02:00 |
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basis_sets.md
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docs: add Quickstep getting-started material (#5100)
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2026-04-26 12:02:00 +02:00 |
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cdft-becke-atomicsize.png
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Manual: Add sub-directories to methods section
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2023-12-10 17:01:50 +01:00 |
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cdft-becke.png
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Manual: Add sub-directories to methods section
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2023-12-10 17:01:50 +01:00 |
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cdft-fragment-constraint.png
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Manual: Add sub-directories to methods section
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2023-12-10 17:01:50 +01:00 |
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cdftci-h2-dissociation.png
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Manual: Add sub-directories to methods section
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2023-12-10 17:01:50 +01:00 |
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cdftscf.png
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Manual: Add sub-directories to methods section
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2023-12-10 17:01:50 +01:00 |
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cneo.md
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CNEO documentation
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2025-09-03 10:35:28 +02:00 |
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constrained.md
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Docs: Switch links to cp2k-examples repository
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2024-07-25 21:16:46 +02:00 |
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convergence.md
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Docs: write build timstamp to page footer, link past releases in CP2K_INPUT, add acronyms, add notes about NaN/Inf, edit convergence.md (#5579)
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2026-07-13 10:55:09 +02:00 |
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cutoff.md
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Docs: Switch links to cp2k-examples repository
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2024-07-25 21:16:46 +02:00 |
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gapw.md
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docs: add Quickstep getting-started material (#5100)
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2026-04-26 12:02:00 +02:00 |
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gapw_h2o.inp
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docs: add Quickstep getting-started material (#5100)
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2026-04-26 12:02:00 +02:00 |
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gauxc.md
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refactor: Remove OneDFT branding from GauXC interface (#5563)
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2026-07-10 09:05:04 +02:00 |
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gpw.md
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docs: add Quickstep getting-started material (#5100)
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2026-04-26 12:02:00 +02:00 |
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index.md
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Docs: add troubleshooting.md, convergence.md, CONTRIBUTING.md symbolic link, and contributions to changelog (#5522)
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2026-07-10 08:59:09 +02:00 |
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k-points.md
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Docs: add troubleshooting.md, convergence.md, CONTRIBUTING.md symbolic link, and contributions to changelog (#5522)
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2026-07-10 08:59:09 +02:00 |
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linear_scaling.md
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Docs: Sprinkle in some recorded talks
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2024-07-26 22:20:21 +02:00 |
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local_ri.md
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Manual: Touch up page names and titles
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2023-12-28 14:29:43 +01:00 |
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lrigpw_example.inp
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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pseudopotentials.md
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docs: add Quickstep getting-started material (#5100)
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2026-04-26 12:02:00 +02:00 |
