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

Revision 1831 - (view) (annotate) - [select for diffs]
Modified Thu Jan 10 14:06:34 2013 UTC (12 years, 3 months ago) by gezelter
File length: 13830 byte(s)
Diff to previous 1794

Merging trunk changes 1812:1830 into development branch.

Revision 1794 - (view) (annotate) - [select for diffs]
Modified Thu Sep 6 19:44:06 2012 UTC (12 years, 7 months ago) by gezelter
File length: 13729 byte(s)
Diff to previous 1767

Merging some of the trunk changes back to the development branch,
cleaning up a datastorage bug

Revision 1767 - (view) (annotate) - [select for diffs]
Modified Fri Jul 6 22:01:58 2012 UTC (12 years, 9 months ago) by gezelter
File length: 13495 byte(s)
Diff to previous 1762

Various fixes required to compile OpenMD with the MS Visual C++ compiler

Revision 1762 - (view) (annotate) - [select for diffs]
Modified Thu Jun 28 20:17:33 2012 UTC (12 years, 10 months ago) by plouden
File length: 13553 byte(s)
Diff to previous 1725

Calculates the tetrahedrality parameter as a function of zbins. Abandon all hope ye who enter here.

Revision 1725 - (view) (annotate) - [select for diffs]
Modified Sat May 26 18:13:43 2012 UTC (12 years, 11 months ago) by gezelter
File length: 13057 byte(s)
Diff to previous 1665

Individual ForceField classes have been removed (they were essentially
all duplicates anyway).  

ForceField has moved to brains, and since only one force field is in
play at any time, the ForceFieldFactory and Register methods have been
removed.

Revision 1665 - (view) (annotate) - [select for diffs]
Modified Tue Nov 22 20:38:56 2011 UTC (13 years, 5 months ago) by gezelter
File length: 13139 byte(s)
Diff to previous 1635

updated copyright notices

Revision 1635 - (view) (annotate) - [select for diffs]
Modified Thu Sep 15 16:24:03 2011 UTC (13 years, 7 months ago) by gezelter
File length: 13073 byte(s)
Diff to previous 1629

cleaning up the development branch a bit, removing cruft, etc.

Revision 1629 - (view) (annotate) - [select for diffs]
Modified Wed Sep 14 21:15:17 2011 UTC (13 years, 7 months ago) by gezelter
File length: 13123 byte(s)
Diff to previous 1601

Merging changes from old branch into development branch

Revision 1601 - (view) (annotate) - [select for diffs]
Modified Thu Aug 4 20:04:35 2011 UTC (13 years, 8 months ago) by gezelter
File length: 11492 byte(s)
Diff to previous 1465

removed spurious prints, fixed one bug, but there's still a parallel problem

Revision 1465 - (view) (annotate) - [select for diffs]
Modified Fri Jul 9 23:08:25 2010 UTC (14 years, 9 months ago) by chuckv
File length: 11548 byte(s)
Diff to previous 1454

Creating busticated version of OpenMD

Revision 1454 - (view) (annotate) - [select for diffs]
Modified Wed Jun 23 19:25:02 2010 UTC (14 years, 10 months ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 11548 byte(s)
Diff to previous 1445

Adding 2-D g(r) module to static props

Revision 1445 - (view) (annotate) - [select for diffs]
Modified Tue Jun 8 20:26:50 2010 UTC (14 years, 10 months ago) by chuckv
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 11047 byte(s)
Diff to previous 1442

Changes to gofrz so you can specify the z length

Revision 1442 - (view) (annotate) - [select for diffs]
Modified Mon May 10 17:28:26 2010 UTC (14 years, 11 months ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 11353 byte(s)
Diff to previous 1440

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 11353 byte(s)
Diff to previous 1413

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 11127 byte(s)
Diff to previous 1390

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 10965 byte(s)
Diff to previous 1267

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 10918 byte(s)
Diff to previous 1222

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 11012 byte(s)
Diff to previous 1213

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 11020 byte(s)
Diff to previous 1180

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 10819 byte(s)
Diff to previous 1128

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 10186 byte(s)
Diff to previous 1091

Added Bond Order Parameter as a function of radius.

Revision 1091 - (view) (annotate) - [select for diffs]
Modified Fri Nov 10 18:45:29 2006 UTC (18 years, 5 months ago) by chuckv
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 9285 byte(s)
Diff to previous 1051

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 9400 byte(s)
Diff to previous 1041

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 9346 byte(s)
Diff to previous 1039

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 9092 byte(s)
Diff to previous 1026

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 8100 byte(s)
Diff to previous 980

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 8183 byte(s)
Diff to previous 963

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 8034 byte(s)
Diff to previous 957

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 8032 byte(s)
Diff to previous 956

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 7930 byte(s)
Diff to previous 955

*** 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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 7870 byte(s)
Diff to previous 840

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 7670 byte(s)
Diff to previous 558

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 7377 byte(s)
Diff to previous 545

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 7299 byte(s)
Diff to previous 544

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 7036 byte(s)
Diff to previous 543

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 5637 byte(s)
Diff to previous 507

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 5366 byte(s)
Diff to previous 369

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 5627 byte(s)
Diff to previous 354

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 5333 byte(s)
Diff to previous 336

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 5908 byte(s)
Diff to previous 326

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 5859 byte(s)
Diff to previous 311

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 5899 byte(s)
Diff to previous 310

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
Original Path: trunk/src/applications/staticProps/StaticProps.cpp
File length: 3380 byte(s)

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