HE Zilong
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d2d9c0e403
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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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Stefano Battaglia
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ad1d558f05
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refactor: Remove OneDFT branding from GauXC interface (#5563)
Co-authored-by: Copilot <223556219+Copilot@users.noreply.github.com>
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2026-07-10 09:05:04 +02:00 |
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HE Zilong
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3c427e6f4d
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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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SY Wang
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9fc3e74bfe
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Reorganize dependency and electronic-structure documentation (#5481)
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2026-07-01 13:23:20 +02:00 |
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SY Wang
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23252ab802
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Revise k-points documentation (#5435)
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2026-06-24 18:08:30 +02:00 |
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Dynamics of Condensed Matter
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daf821cd15
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Reuse symmetry-reduced SCF MOs in the Wannier90 k-point export (H. Mirhosseini)
Reuse symmetry-reduced SCF MOs in the Wannier90 k-point export.
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2026-05-17 18:30:20 +02:00 |
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Dynamics of Condensed Matter
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42dbd02aed
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Wannier90: export SCF k-point meshes (#5179)
Co-authored-by: Thomas D. Kuehne <tkuehne@cp2k.org>
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2026-05-13 01:08:59 +02:00 |
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Dynamics of Condensed Matter
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02caa0904f
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Extend k-point symmetry backends to closed GENERAL sets (#5173)
Co-authored-by: Thomas D. Kuehne <tkuehne@cp2k.org>
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2026-05-13 00:19:52 +02:00 |
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Dynamics of Condensed Matter
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c92e8381f7
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docs: add Quickstep getting-started material (#5100)
Co-authored-by: Thomas D. Kuehne <tkuehne@cp2k.org>
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2026-04-26 12:02:00 +02:00 |
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Augustin Bussy
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f664ec648c
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Updates to RI-HFXk docs
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2026-03-31 13:34:48 +02:00 |
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zc62
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63a7c4bee4
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CNEO documentation
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2025-09-03 10:35:28 +02:00 |
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Ole Schütt
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31acbd8641
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Docs: Add more acronyms and empty k-point page
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2025-01-08 22:43:56 +01:00 |
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Ole Schütt
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8535040288
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Docs: Fix diagram in methods/dft/gpw.md
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2024-12-28 14:05:07 +01:00 |
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Ole Schütt
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02861f8d08
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Docs: Intro text and flowchart to GPW page
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2024-12-21 17:25:14 +01:00 |
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Augustin Bussy
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feaa26d2cd
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Added journal reference
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2024-07-30 09:51:44 +02:00 |
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Ole Schütt
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96bff0e4cc
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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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Ole Schütt
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df1522a844
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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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Andre Borrfors
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83ed01107c
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fixed cutoff and rel_cutoff tutorial
squash various syntax edits
pretty
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2024-05-25 23:06:56 +02:00 |
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Ole Schütt
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10d5862cfd
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Manual: Add support for youtube videos
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2024-04-09 23:50:49 +02:00 |
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Ole Schütt
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39e565f3c0
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Manual: Set TOC maxdepth=2 in subfolder indexes
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2024-02-25 16:33:46 +01:00 |
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Ole Schütt
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143fc55fcf
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Manual: Create folder for Hartree-Fock Exchange
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2024-02-23 23:20:00 +01:00 |
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Ole Schütt
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94016fe734
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Manual: Add links to RI-HFX page
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2024-01-26 15:55:04 +01:00 |
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abussy
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d90c47c072
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RI-HFX (incl. k-points) docs/tuto
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2024-01-22 11:38:57 +01:00 |
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Ole Schütt
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75a566c04f
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Manual: Add more links to placeholder pages
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2024-01-14 15:24:48 +01:00 |
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Ole Schütt
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c078969bf9
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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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Ole Schütt
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2b6ea54d62
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Format all input files
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2023-12-18 22:41:19 +01:00 |
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Ole Schütt
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668feff676
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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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