[ViewVC] Log of: OpenMD/trunk/src/applications/staticProps/StaticProps.cpp

Revision 1442 - (view) (annotate) - [select for diffs]
Modified Mon May 10 17:28:26 2010 UTC (14 years, 11 months ago) by gezelter
File length: 11353 byte(s)
Diff to previous 1440 , to selected 1091

Adding property set to svn entries

Revision 1440 - (view) (annotate) - [select for diffs]
Modified Thu Apr 29 14:41:48 2010 UTC (15 years ago) by gezelter
File length: 11353 byte(s)
Diff to previous 1413 , to selected 1091

Adding a new correlation function to do slab-segregated g(r)
calculations.  This computes at g(r) for pairs while requiring the z
coordinates of the two sites to be at fixed separations.  The data
is output in:  r, z, g(r,z)

Revision 1413 - (view) (annotate) - [select for diffs]
Modified Mon Mar 22 19:21:22 2010 UTC (15 years, 1 month ago) by gezelter
File length: 11127 byte(s)
Diff to previous 1390 , to selected 1091

Adding a progress bar, and pAngle staticProps

Revision 1390 - (view) (annotate) - [select for diffs]
Modified Wed Nov 25 20:02:06 2009 UTC (15 years, 5 months ago) by gezelter
File length: 10965 byte(s)
Diff to previous 1267 , to selected 1091

Almost all of the changes necessary to create OpenMD out of our old
project (OOPSE-4)

Revision 1267 - (view) (annotate) - [select for diffs]
Modified Mon Jun 30 17:53:42 2008 UTC (16 years, 10 months ago) by gpuliti
File length: 10918 byte(s)
Diff to previous 1222 , to selected 1091

Fixed a number of bugs in slab_density calculation

Revision 1222 - (view) (annotate) - [select for diffs]
Modified Wed Jan 23 22:01:34 2008 UTC (17 years, 3 months ago) by gezelter
File length: 11012 byte(s)
Diff to previous 1213 , to selected 1091

Correcting a few typos

Revision 1213 - (view) (annotate) - [select for diffs]
Modified Wed Jan 23 21:21:50 2008 UTC (17 years, 3 months ago) by xsun
File length: 11020 byte(s)
Diff to previous 1180 , to selected 1091

fixed a few correlation functions

Revision 1180 - (view) (annotate) - [select for diffs]
Modified Mon Sep 17 20:05:51 2007 UTC (17 years, 7 months ago) by chuckv
File length: 10819 byte(s)
Diff to previous 1128 , to selected 1091

Added code to compute bond angle distributions.

Revision 1128 - (view) (annotate) - [select for diffs]
Modified Wed Apr 11 23:27:20 2007 UTC (18 years ago) by chuckv
File length: 10186 byte(s)
Diff to previous 1091

Added Bond Order Parameter as a function of radius.

Revision 1091 - (view) (annotate) - [selected]
Modified Fri Nov 10 18:45:29 2006 UTC (18 years, 5 months ago) by chuckv
File length: 9725 byte(s)
Diff to previous 1052

Added support for nanoparticle density profile.

Revision 1052 - (view) (annotate) - [select for diffs]
Modified Tue Sep 26 01:30:32 2006 UTC (18 years, 7 months ago) by gezelter
File length: 9285 byte(s)
Diff to previous 1051 , to selected 1091

Mostly done with BondOrderParameter.  Only a few performance tweaks
remain

Revision 1051 - (view) (annotate) - [select for diffs]
Modified Mon Sep 25 22:08:33 2006 UTC (18 years, 7 months ago) by gezelter
File length: 9400 byte(s)
Diff to previous 1041 , to selected 1091

fixing bond order parameter code

Revision 1041 - (view) (annotate) - [select for diffs]
Modified Wed Sep 20 20:13:40 2006 UTC (18 years, 7 months ago) by gezelter
File length: 9346 byte(s)
Diff to previous 1039 , to selected 1091

fixed bugs (mostly in BondOrderParameter)

Revision 1039 - (view) (annotate) - [select for diffs]
Modified Tue Sep 19 21:14:11 2006 UTC (18 years, 7 months ago) by gezelter
File length: 9092 byte(s)
Diff to previous 1026 , to selected 1091

Working on BondOrderParameter

Revision 1026 - (view) (annotate) - [select for diffs]
Modified Wed Aug 30 21:04:04 2006 UTC (18 years, 8 months ago) by gezelter
File length: 8100 byte(s)
Diff to previous 980 , to selected 1091

Changing utility programs to use the new file format

Revision 980 - (view) (annotate) - [select for diffs]
Modified Thu Jun 1 18:06:33 2006 UTC (18 years, 11 months ago) by xsun
File length: 8183 byte(s)
Diff to previous 963 , to selected 1091

Add the RippleOP to calculate the orderparameter of the ripples.

Revision 963 - (view) (annotate) - [select for diffs]
Modified Wed May 17 21:51:42 2006 UTC (18 years, 11 months ago) by tim
File length: 8034 byte(s)
Diff to previous 957 , to selected 1091

Adding single precision capabilities to c++ side

Revision 957 - (view) (annotate) - [select for diffs]
Modified Tue May 16 20:38:23 2006 UTC (18 years, 11 months ago) by gezelter
File length: 8032 byte(s)
Diff to previous 956 , to selected 1091

Autoconf fixes for FFTW.  Multiple FFTW version support.

Revision 956 - (view) (annotate) - [select for diffs]
Modified Tue May 16 02:06:37 2006 UTC (18 years, 11 months ago) by gezelter
File length: 7930 byte(s)
Diff to previous 955 , to selected 1091

*** empty log message ***

Revision 955 - (view) (annotate) - [select for diffs]
Modified Fri May 12 21:34:43 2006 UTC (18 years, 11 months ago) by xsun
File length: 7870 byte(s)
Diff to previous 840 , to selected 1091

Changes to calculate undulation spectrum

Revision 840 - (view) (annotate) - [select for diffs]
Modified Mon Jan 9 22:14:32 2006 UTC (19 years, 3 months ago) by tim
File length: 7670 byte(s)
Diff to previous 558 , to selected 1091

fixing RhoZ

Revision 558 - (view) (annotate) - [select for diffs]
Modified Mon Jun 13 18:25:30 2005 UTC (19 years, 10 months ago) by tim
File length: 7377 byte(s)
Diff to previous 545 , to selected 1091

working version of DensityPlot

Revision 545 - (view) (annotate) - [select for diffs]
Modified Fri May 27 21:11:24 2005 UTC (19 years, 11 months ago) by tim
File length: 7299 byte(s)
Diff to previous 544 , to selected 1091

adding DensityPlot into StaticProps

Revision 544 - (view) (annotate) - [select for diffs]
Modified Fri May 27 04:41:34 2005 UTC (19 years, 11 months ago) by tim
File length: 7036 byte(s)
Diff to previous 543 , to selected 1091

adding SCDOrderParameter into StaticProps

Revision 543 - (view) (annotate) - [select for diffs]
Modified Thu May 26 22:45:00 2005 UTC (19 years, 11 months ago) by tim
File length: 5637 byte(s)
Diff to previous 507 , to selected 1091

adding AtomNameVisitor to convert atom name to its base name; wrappingvisitor
now wrap back to the center of the mass; adding P2OrderParameter into StaticProps

Revision 507 - (view) (annotate) - [select for diffs]
Modified Fri Apr 15 22:04:00 2005 UTC (20 years ago) by gezelter
File length: 5366 byte(s)
Diff to previous 369 , to selected 1091

xemacs has been drafted to perform our indentation services

Revision 369 - (view) (annotate) - [select for diffs]
Modified Fri Feb 18 23:07:32 2005 UTC (20 years, 2 months ago) by tim
File length: 5627 byte(s)
Diff to previous 354 , to selected 1091

adding LipidTransVisitor, GofXyz is working now

Revision 354 - (view) (annotate) - [select for diffs]
Modified Wed Feb 16 20:30:50 2005 UTC (20 years, 2 months ago) by tim
File length: 5333 byte(s)
Diff to previous 336 , to selected 1091

change the default bin number

Revision 336 - (view) (annotate) - [select for diffs]
Modified Mon Feb 14 18:51:48 2005 UTC (20 years, 2 months ago) by tim
File length: 5908 byte(s)
Diff to previous 326 , to selected 1091

default length for staticProps is 1/2 smallest length of first frame

Revision 326 - (view) (annotate) - [select for diffs]
Modified Sun Feb 13 20:05:42 2005 UTC (20 years, 2 months ago) by tim
File length: 5859 byte(s)
Diff to previous 311 , to selected 1091

maximum length defaults to the cutoff radius

Revision 311 - (view) (annotate) - [select for diffs]
Modified Thu Feb 10 22:37:21 2005 UTC (20 years, 2 months ago) by tim
File length: 5899 byte(s)
Diff to previous 310 , to selected 1091

more work in StaticProps

Revision 310 - (view) (annotate) - [select for diffs]
Added Thu Feb 10 18:14:03 2005 UTC (20 years, 2 months ago) by tim
File length: 3380 byte(s)
Diff to selected 1091

change the filenames

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