Merge branch 'release/v.1.3.0' into develop

ttadano · Oct 1, 2021 · 0854d2c · 0854d2c
2 parents 8ed05bf + bb7213e
commit 0854d2c
Show file tree

Hide file tree

Showing 8 changed files with 33 additions and 14 deletions.
diff --git a/ChangeLog.md b/ChangeLog.md
@@ -1,3 +1,16 @@
+# Ver. 1.3.0 (2021-10-01)
+
+## Changes
+
+- For OpenMX, displace.py now generates atomic positions in Cartesian coordinate instead of the fractional coordinate.
+- Refactor the codes for future major release (This release does not change the user interface.)
+
+## Fixes
+
+- Fix a few bugs in the SCP class. The stability of the phonon frequency interpolation has been improved.
+- Fix other minor bugs and typos in documentation and header parts of output files.
+
+
 # Ver. 1.2.0 (2021-04-02)
 
 ## New features

diff --git a/LICENSE.txt b/LICENSE.txt
@@ -1,6 +1,6 @@
 The MIT License (MIT)
 
-Copyright (c) 2014,2015,2016 Terumasa Tadano
+Copyright (c) 2014 Terumasa Tadano
 
 Permission is hereby granted, free of charge, to any person obtaining a copy
 of this software and associated documentation files (the "Software"), to deal

diff --git a/README.md b/README.md
@@ -3,7 +3,7 @@
 [![License][license-image]][license-url]
 [![Doc status][docs-image]][docs-url]
 
-### Version 1.2.0
+### Version 1.3.0
 ![alt ALAMODE](./docs/img/alamode.png)
 
 
@@ -89,7 +89,7 @@ http://alamode.readthedocs.io
 
 
 ## License
-Copyright (c) 2014--2019 Terumasa Tadano
+Copyright (c) 2014–2021 Terumasa Tadano
 This software is released under the MIT license. 
 For license rights and limitations, see LICENSE.txt file.
 

diff --git a/docs/source/conf.py b/docs/source/conf.py
@@ -57,9 +57,9 @@
 # built documents.
 #
 # The short X.Y version.
-version = '1.2'
+version = '1.3'
 # The full version, including alpha/beta/rc tags.
-release = '1.2.0'
+release = '1.3.0'
 
 # The language for content autogenerated by Sphinx. Refer to documentation
 # for a list of supported languages.

diff --git a/docs/source/download.rst b/docs/source/download.rst
@@ -1,12 +1,9 @@
 Download
 ========
 
-.. highlight:: bash
-
-
 You can download the latest and previous versions of ALAMODE at http://sourceforge.net/projects/alamode .
 
-You can also download the package from the git repository as
+You can also download the package from the git repository as::
 
     $ git clone http://github.com/ttadano/alamode.git
 

diff --git a/docs/source/install.rst b/docs/source/install.rst
@@ -46,7 +46,7 @@ VMD may be more useful to make an animation, but it may be replaced by any other
 Install using conda (recommended for non-experts)
 -------------------------------------------------
 
-.. highlight:: bash
+..highlight:: bash
 
 This option is recommended for all users who want to build working binaries. 
 If you want to build highly-optimized binaries using the Intel compiler and other optimized libraries, 
@@ -59,7 +59,7 @@ Step 1. Preparing build tools by conda
 At first, it is recommended `to prepare a conda environment
 <https://conda.io/docs/user-guide/tasks/manage-environments.html#creating-an-environment-with-commands>`_ by::
 
-   % conda create --name alamode -c conda-forge python=3.7
+   % conda create --name alamode -c conda-forge python=3
    % conda activate alamode
 
 Here the name of the conda environment is chosen ``alamode``. The detailed

diff --git a/docs/source/intro.rst b/docs/source/intro.rst
@@ -69,7 +69,7 @@ License
 
 .. |copy|   unicode:: U+000A9 
 
-Copyright |copy| 2014, 2015, 2016 Terumasa Tadano
+Copyright |copy| 2014–2021 Terumasa Tadano
 
 This software is distributed under the MIT license.
 See the LICENSE.txt file for license rights and limitations. 
@@ -94,10 +94,19 @@ please cite the following paper as well:
   Y\. Oba, T. Tadano, R. Akashi, and S. Tsuneyuki, Phys. Rev. Materials **3**\, 033601 (2019). 
   [`Link <https://journals.aps.org/prmaterials/abstract/10.1103/PhysRevMaterials.3.033601>`__]
 
+
+Issues & Bug report
+-------------------
+
+* If you find a bug or issue related to ALAMODE, please report it at `GitHub issues <https://github.com/ttadano/alamode/issues/>`_. 
+* Other questions and suggestions can be posted on the `GitHub discussion page. <https://github.com/ttadano/alamode/discussions>`_
+
+In either case, please search the previous questions and read FAQ page of this document before asking.
+
 Acknowledgment
 --------------
 
-This project is/was partially supported by the following projects:
+This project was partially supported by the following projects:
 
 * Grant-in-Aid for Young Scientists (B) (16K17724) 
 * Grant-in-Aid for Scientific Research on Innovative Areas 'Materials Design through Computics: Complex Correlation and Non-Equilibrium Dynamics'. (http://computics-material.jp)

diff --git a/include/version.h b/include/version.h
@@ -12,4 +12,4 @@
 
 #include <string>
 
-static const std::string ALAMODE_VERSION = "1.2.0";
+static const std::string ALAMODE_VERSION = "1.3.0";
Original file line number	Diff line number	Diff line change
Expand Up		@@ -12,4 +12,4 @@

		#include <string>

		static const std::string ALAMODE_VERSION = "1.2.0";
		static const std::string ALAMODE_VERSION = "1.3.0";