Top Page > Browsing
Patch 3.9.3 to OpenMX Ver. 3.9
Date: 2021/08/13 00:52
Name: T. Ozaki

Dear all,

A patch 3.9.3 for OpenMX Ver. 3.9 has been released at
http://www.openmx-square.org/download.html

The release note is available at
http://www.openmx-square.org/bugfixed/21Aug13/README.txt

Known bugs reported in the OpenMX Forum and also by users will be fixed by applying the patch.
How to apply the patch is found in README.txt.

Thank you very much for your cooperation in advance.

Best regards,

Taisuke Ozaki
メンテ
Page: [1]

Re: Patch 3.9.3 to OpenMX Ver. 3.9 ( No.1 )
Date: 2021/08/14 05:09
Name: T. Ozaki

Dear all,

A patch 3.9.4 for OpenMX Ver. 3.9 has been released at
http://www.openmx-square.org/download.html

The release note is available at
http://www.openmx-square.org/bugfixed/21Aug14/README.txt

Known bugs reported in the OpenMX Forum and also by users will be fixed by applying the patch.
How to apply the patch is found in README.txt.

Since the patch 3.9.3, released on Aug. 13th, 2021, does not include the following files:

MulPOnly.c
Occupation_Number_LDA_U.c
TRAN_Add_Density_Lead.c
neb_run.c

which have been patched by the patch 3.9.2, I have included those files in the patch 3.9.4.

Sorry for your inconvenience and thank you very much for your cooperation in advance.

Best regards,

Taisuke Ozaki
メンテ
Re: Patch 3.9.3 to OpenMX Ver. 3.9 ( No.2 )
Date: 2021/08/14 13:43
Name: T. Ozaki

Dear all,

A patch 3.9.5 to OpenMX Ver. 3.9 has been released at
http://www.openmx-square.org/download.html
since the directory structure of the patch 3.9.4, released on Aug. 14th, 2021,
may cause a trouble in the re-installation.

The purpose of the patch and how to apply it can be found at
http://www.openmx-square.org/bugfixed/21Aug14/README.txt

Sorry for your inconvenience and thank you very much for your cooperation in advance.

Best regards,

Taisuke Ozaki
メンテ
Re: Patch 3.9.3 to OpenMX Ver. 3.9 ( No.3 )
Date: 2021/08/21 13:13
Name: T. Ozaki

Dear all,

To resolve an issue reported at
http://www.openmx-square.org/forum/patio.cgi?mode=view&no=2875
a patch 3.9.6 to OpenMX Ver. 3.9 has been released at
http://www.openmx-square.org/download.html

The purpose of the patch and how to apply it can be found at
http://www.openmx-square.org/bugfixed/21Aug21/README.txt

Thank you very much for your cooperation in advance.

Best regards,

Taisuke Ozaki
メンテ
Re: Patch 3.9.3 to OpenMX Ver. 3.9 ( No.4 )
Date: 2021/09/15 09:42
Name: T. Ozaki

Dear all,

A patch 3.9.7 to OpenMX Ver. 3.9 has been released at
http://www.openmx-square.org/download.html

An instability issue of DFT-D2 and DFT-D3 has been fixed and the variable cell optimization
including DFT-D2 and DFT-D3 has been supported. Also, the compilation issue of MulPOnly has
been fixed. All the purposes of the patch and how to apply it can be found at
http://www.openmx-square.org/bugfixed/21Sep15/README.txt

Thank you very much for your cooperation in advance.

Best regards,

Taisuke Ozaki
メンテ
Re: Patch 3.9.3 to OpenMX Ver. 3.9 ( No.5 )
Date: 2021/09/28 09:53
Name: T. Ozaki

Dear all,

A patch 3.9.8 to OpenMX Ver. 3.9 has been released at
http://www.openmx-square.org/download.html

A bug related to DFT-D2 and DFT-D3 has been fixed.
All the purposes of the patch and how to apply it can be found at
http://www.openmx-square.org/bugfixed/21Sep28/README.txt

Thank you very much for your cooperation in advance.

Best regards,

Taisuke Ozaki
メンテ
Re: Patch 3.9.3 to OpenMX Ver. 3.9 ( No.6 )
Date: 2021/10/17 22:25
Name: T. Ozaki

Dear all,

A patch 3.9.9 to OpenMX Ver. 3.9 has been released at
http://www.openmx-square.org/download.html


Related to Cluster_DFT_Col.c:
The calculation of the partial charge was not properly performed when only the Gamma point is employed.
All the purposes of the patch and how to apply it can be found at
http://www.openmx-square.org/bugfixed/21Oct17/README.txt

Thank you very much for your cooperation in advance.

Best regards,

Taisuke Ozaki
メンテ

Page: [1]

Thread Title (must) Move the thread to the top
Your Name (must)
E-Mail (must)
URL
Password (used in modification of the submitted text)
Comment (must)

   Save Cookie