From ee3520318c61995f33540b2e0d263ff7da89320f Mon Sep 17 00:00:00 2001 From: __sp__ Date: Sat, 12 Dec 2015 07:51:42 -0800 Subject: [PATCH] v3.2.9 release Former-commit-id: c7c2aeb7b184778c6b04aa3b84616c3a0b5c5bd0 [formerly 02585341b40bfa36c9608be405d390e011ce2d0d] Former-commit-id: fbf4c334dc5f7a6414e3fe775ed1bf10074b172b --- docs/change_log.rst | 9 +++++++++ docs/latest_changes.rst | 13 +++++++------ pymatgen/__init__.py | 4 ++-- setup.py | 2 +- 4 files changed, 19 insertions(+), 9 deletions(-) diff --git a/docs/change_log.rst b/docs/change_log.rst index 6e2123a59e6..811dbdadf12 100644 --- a/docs/change_log.rst +++ b/docs/change_log.rst @@ -1,6 +1,15 @@ Change log ========== +v3.2.9 +------ +* Major PD stability improvements, especially for very high dim hulls with lots + of entries. +* Improvements to Ewald summation to be close to GULP implementation. +* Deprecate physical constants module in favor of scipy's version. +* Remove many pyhull references to use scipy's ConvexHull implementation. +* Bug fix for sulfide correction. + v3.2.8 ------ diff --git a/docs/latest_changes.rst b/docs/latest_changes.rst index 21c0bb34949..ea712369541 100644 --- a/docs/latest_changes.rst +++ b/docs/latest_changes.rst @@ -1,10 +1,11 @@ Change log ========== -v3.2.8 +v3.2.9 ------ -* Make pyhull optional. -* Sulfur correction added to MaterialsProjectCompatibility for more accurate - sulfide formation energies. -* ADF io support. (Xin Chen) -* Bug fixes for spacegroup subgroup testing. +* Major PD stability improvements, especially for very high dim hulls with lots + of entries. +* Improvements to Ewald summation to be close to GULP implementation. +* Deprecate physical constants module in favor of scipy's version. +* Remove many pyhull references to use scipy's ConvexHull implementation. +* Bug fix for sulfide correction. diff --git a/pymatgen/__init__.py b/pymatgen/__init__.py index 28e4764ceb4..4653c66147f 100644 --- a/pymatgen/__init__.py +++ b/pymatgen/__init__.py @@ -4,8 +4,8 @@ __email__ ="pymatgen@googlegroups.com" __maintainer__ = "Shyue Ping Ong" __maintainer_email__ ="shyuep@gmail.com" -__date__ = "Dec 6 2015" -__version__ = "3.2.8" +__date__ = "Dec 12 2015" +__version__ = "3.2.9" # Useful aliases for commonly used objects and modules. diff --git a/setup.py b/setup.py index b30e6cdb7fd..8c61f46ae20 100644 --- a/setup.py +++ b/setup.py @@ -51,7 +51,7 @@ def get_spglib_ext(): setup( name="pymatgen", packages=find_packages(), - version="3.2.8", + version="3.2.9", install_requires=["numpy>=1.9", "six", "atomicfile", "requests", "pybtex", "pyyaml", "monty>=0.7.0", "scipy>=0.14", "tabulate"],