d3q / Code Commit Log

Commit	Date
[r279] by paulatz maxdiff fixed for negative difference, more user friendly suppress verbose error message when file is not found	2017-06-21 13:55:39	Tree
[r278] by paulatz "found" parameter added, documentation, bugfixes	2017-06-21 13:54:51	Tree
[r277] by paulatz Format fixed for reps with 3 or 4 modes	2017-06-21 13:54:22	Tree
[r276] by paulatz Tiny bug fixes	2017-06-21 13:53:45	Tree
[r275] by paulatz New README	2017-06-20 15:27:17	Tree
[r274] by paulatz New dependencies makefile auto-generates the list of object files, the manual list is still present, I will remove it wafter testing	2017-06-20 15:02:19	Tree
[r273] by paulatz Clearify that it is the inner grid that is being set up	2017-06-20 15:00:45	Tree
[r272] by paulatz Annoying positional arguments replaced with keyword arguments, i.e. instead of specifying d3_qq2rr.x 3 3 3 mat3R 1 you now specify d3_qq2rr -o mat3R 3 3 3 -f 1 Where the order of arguments does not matter, also optional arguments work better and the possibility of writing intermediate D3 matrices has been added to import3py and recenter (option -w)	2017-06-20 15:00:22	Tree
[r271] by paulatz Added a CONJG to take the complex conjugate of the input D3 matrix, it is actually the d3q code that should be modified, to give the correct output, this is a quick work-around	2017-06-20 14:58:34	Tree
[r270] by paulatz A few quite important bug fixes thanks to Francesco Macheda who helped with debugging. A factor 1/2 was missing in the SMA thermal conductivity i.e. the intrinsic HWHM was used instead of the intrinsic HWHM. On the other hand, the correct FWHM was used for the isotopic and casimi contribution, now all three values are consistent and, more importantly correct. The CGP algorithm, being checkd on SMA, was also missing a factor 0.5	2017-06-20 14:57:52	Tree

[r279] by paulatz

maxdiff fixed for negative difference,
more user friendly
suppress verbose error message when file is not found

2017-06-21 13:55:39

Tree

[r278] by paulatz

"found" parameter added, documentation, bugfixes

2017-06-21 13:54:51

Tree

[r277] by paulatz

Format fixed for reps with 3 or 4 modes

2017-06-21 13:54:22

Tree

[r276] by paulatz

Tiny bug fixes

2017-06-21 13:53:45

Tree

[r275] by paulatz

New README

2017-06-20 15:27:17

Tree

[r274] by paulatz

New dependencies

makefile auto-generates the list of object files, the manual list is still present, I will remove it wafter testing

2017-06-20 15:02:19

Tree

[r273] by paulatz

Clearify that it is the inner grid that is being set up

2017-06-20 15:00:45

Tree

[r272] by paulatz

Annoying positional arguments replaced with keyword arguments, i.e. instead of specifying

d3_qq2rr.x 3 3 3 mat3R 1

you now specify

d3_qq2rr -o mat3R 3 3 3 -f 1

Where the order of arguments does not matter, also optional arguments work better and the possibility of writing intermediate D3 matrices has been added to import3py and recenter (option -w)

2017-06-20 15:00:22

Tree

[r271] by paulatz

Added a CONJG to take the complex conjugate of the input D3 matrix, it is actually the d3q code that should be modified, to give the correct output, this is a quick work-around

2017-06-20 14:58:34

Tree

[r270] by paulatz

A few quite important bug fixes thanks to Francesco Macheda who helped with debugging.

A factor 1/2 was missing in the SMA thermal conductivity i.e. the intrinsic HWHM was used instead of the intrinsic HWHM. On the other hand, the correct FWHM was used for the isotopic and casimi contribution, now all three values are consistent and, more importantly correct.

The CGP algorithm, being checkd on SMA, was also missing a factor 0.5

2017-06-20 14:57:52

Tree

d3q Code

Code Commit Log