Resgrp:comp-photo-version control-local-dev-master
This page will show the current state of the group's master dev repository /home/gaussian-devel/repositories/local-dev-master.
It will document what code is currently considered to be accepted as ready to use.
The format is explained here. You don't have to describe each revision, just whatever the tip is at the time, and whatever might be (or have been) made into a compiled version.
The revisions
The most recent revision (which should be the tip) should always be on top. Note that the "tip" tag may appear incorrectly below. Also note that the local revision numbers (e.g. 56 in changeset: 56:e359f0e1aa5c) may differ in other repositories. If in doubt, use the hex number.
changeset: 92:be0e7e296f2f
user: Simon Clifford <simon.j.clifford@gmail.com> date: Sun Nov 17 22:44:39 2013 +0000 summary: Local development merged with H32
Local development merged with H32
This entailed quite a bit of editing with the onifrq code, as it appears some of these changes have been migrated to H32, with Gaussian Inc changes as well. I kept as much as possible of the H32 code, as this is what's already been accepted by Gau Inc.
changeset: 73:923d6c51169a
user: Simon Clifford <simon.j.clifford@gmail.com> date: Fri Jan 18 17:11:08 2013 +0000 summary: Fixed bug where ONIOM jobs would fail with:
Updated version fixing a bug where ONIOM 2nd derivative jobs would fail with a message like:
ONIOM: calculating second derivatives. NInts<0 in InToWP. Error termination via Lnk1e in /home/gaussian-devel/versions/rev-a7f8ac5c6a00-i386-pg12.9/gdv/l120.exe at Fri Jan 11 18:06:43 2013.
changeset: 72:a7f8ac5c6a00
parent: 70:f87f732e26fb parent: 71:69b842c84566 user: Simon Clifford <simon.j.clifford@gmail.com> date: Wed Nov 21 14:12:01 2012 +0000 summary: Merged in more updates to makefiles (h23)
DEPRECATED: see revision 73:923d6c51169a.
This revision contains the Shaopeng matrix element code, the seam following code, and the ONIOM frequency analysis code. They are all merged to be compatible with H23.
I have also added into the repository test jobs for each of these local changes. These are stored in
an upper directory called local-tests.
changeset: 56:e359f0e1aa5c
parent: 55:f6c5e2290dc4 parent: 53:c7f36daff923 user: Simon Clifford <simon.j.clifford@gmail.com> date: Wed Oct 10 14:56:24 2012 +0100 summary: Merged Shaopeng, seamfollowing, olddirect (H23)
DEPRECATED: Do not use, likely to crash. See rev 57:0c20d50c4185.
The merge of the three features. Based off H23.
changeset: 55:f6c5e2290dc4
parent: 54:0c83655a3822 parent: 41:c8a317a36a4e user: Simon Clifford <simon.j.clifford@gmail.com> date: Wed Oct 10 14:55:17 2012 +0100 summary: Merged olddirect code to H23
DEPRECATED: Do not use, likely to crash. See rev 57:0c20d50c4185.
Simon's updates and fixes for the semi-direct matrix element code. Based off H23.
changeset: 53:c7f36daff923
parent: 52:e11a2fc5b5a8 parent: 41:c8a317a36a4e user: Simon Clifford <simon.j.clifford@gmail.com> date: Wed Oct 10 12:38:05 2012 +0100 summary: Shaopeng + seamfollowing, merged to H23.
DEPRECATED: Do not use, likely to crash. See rev 57:0c20d50c4185.
The Shaopeng code and seamfollowing code as below, updated to H23.
changeset: 51:dcd851f8dc57
parent: 50:c0a9f878ea3e parent: 39:c90162c4fbe6 user: Simon Clifford <simon.j.clifford@gmail.com> date: Tue Oct 09 22:15:18 2012 +0100 summary: Updated seamfollowing code to H21
DEPRECATED: Do not use, likely to crash. See rev 57:0c20d50c4185.
This is the imported seam following code updated to H21.
changeset: 49:bda0e1259a36
user: Simon Clifford <simon.j.clifford@gmail.com> date: Mon Jul 02 15:04:35 2012 +0100 summary: Large modification and cleanup of Shaopeng code. Below for details.
This contains the Shaopeng matrix element code with most of Simon's modifications and bug fixes in place. It's based off version H21
changeset: 41:c8a317a36a4e
tag: h23 parent: 40:cfd3ea6fcdff parent: 25:7a8a763281d4 user: Simon Clifford <simon.j.clifford@gmail.com> date: Mon Oct 08 17:45:00 2012 +0100 summary: Merged in H23
This is official Gaussian version H23.
changeset: 39:c90162c4fbe6
tag: h21 parent: 38:ef0c2dff2d79 parent: 20:dd575870f775 user: Simon Clifford <simon.j.clifford@gmail.com> date: Mon Oct 08 17:44:00 2012 +0100 summary: Merged in H21
This is official Gaussian version H21.
changeset: 37:e972407aab01
tag: h13 parent: 36:9d36f9fe483b parent: 17:770721638a7a user: Simon Clifford <simon.j.clifford@gmail.com> date: Mon Oct 08 17:43:06 2012 +0100 summary: Merged in H13
This is official Gaussian version H13.
changeset: 35:10679662e3a3
tag: h12p parent: 34:3ce1603d2c6c parent: 16:427978d67ed6 user: Simon Clifford <simon.j.clifford@gmail.com> date: Mon Oct 08 17:42:11 2012 +0100 summary: Merged in H12p
This is official Gaussian version H12p.
changeset: 33:a0e0a314db85
tag: h11 parent: 32:3732a6888cc4 parent: 15:27066b86194e user: Simon Clifford <simon.j.clifford@gmail.com> date: Mon Oct 08 17:39:49 2012 +0100 summary: Merged in H11
This is official Gaussian version H11.
changeset: 31:7d8a337a7324
tag: h10 parent: 30:86c2a0b6f977 parent: 14:62f983246ba7 user: Simon Clifford <simon.j.clifford@gmail.com> date: Mon Oct 08 17:39:11 2012 +0100 summary: Merged in H10
This is official Gaussian version H10.
changeset: 29:56fa127c847c
tag: h08 parent: 28:877924b27ee3 parent: 13:903ac662c7a2 user: Simon Clifford <simon.j.clifford@gmail.com> date: Mon Oct 08 17:38:04 2012 +0100 summary: Merged in H08
This is official Gaussian version H08.
changeset: 27:a05e10e365c2
tag: h01 parent: -1:000000000000 parent: 12:ae8da988f728 user: Simon Clifford <simon.j.clifford@gmail.com> date: Mon Oct 08 17:35:05 2012 +0100 summary: Fixed bug where code compiled with PGI >= 12 would fail with thread error.
This is official Gaussian version H01.
Formatting
The format is:
changeset: 56:e359f0e1aa5c
tag: tip parent: 55:f6c5e2290dc4 parent: 53:c7f36daff923 user: Simon Clifford <simon.j.clifford@gmail.com> date: Wed Oct 10 14:56:24 2012 +0100 summary: Merged Shaopeng, seamfollowing, olddirect (H23)
Text explaining what this revision contains, e.g. all of the below plus merged up to H23
In raw form that's:
===changeset: 56:e359f0e1aa5c===
tag: tip
parent: 55:f6c5e2290dc4
parent: 53:c7f36daff923
user: Simon Clifford <simon.j.clifford@gmail.com>
date: Wed Oct 10 14:56:24 2012 +0100
summary: Merged Shaopeng, seamfollowing, olddirect (H23)
Text explaining what this revision contains,
e.g. all of the below plus merged up to H23
This is the output from hg log with the changeset line made into a header, a space
added to the start of each following line, and more
explanatory text. NB, it's important to add more explanation!