[ViewVC] Log of: OpenMD/branches/heatflux/src/applications/staticProps/StaticPropsCmd.c

Revision 1670 - (view) (annotate) - [select for diffs]
Modified Fri Jan 27 19:07:19 2012 UTC (13 years, 10 months ago) by chuckv
File length: 57286 byte(s)
Diff to previous 1585

Adding experimental branch for calculation of the heatflux based on old version of OpenMD.
This will need to be ported to the development branch later.

Revision 1585 - (view) (annotate) - [select for diffs]
Modified Sun Jun 19 17:51:15 2011 UTC (14 years, 5 months ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 57286 byte(s)
Diff to previous 1542

Added a module to compute the length of a nanorod

Revision 1542 - (view) (annotate) - [select for diffs]
Modified Thu Mar 3 20:32:49 2011 UTC (14 years, 9 months ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 56330 byte(s)
Diff to previous 1531

Adding vector handling capability to P2 order parameter

Revision 1531 - (view) (annotate) - [select for diffs]
Modified Wed Dec 29 16:48:19 2010 UTC (14 years, 11 months ago) by kstocke1
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 56312 byte(s)
Diff to previous 1526

fixed gengetopt generated files to fix pAngle bug

Revision 1526 - (view) (annotate) - [select for diffs]
Modified Wed Nov 24 17:40:12 2010 UTC (15 years ago) by kstocke1
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 53823 byte(s)
Diff to previous 1522

Completed SMIPD to Langevin Hull integrator name change

Revision 1522 - (view) (annotate) - [select for diffs]
Modified Fri Nov 19 20:26:36 2010 UTC (15 years ago) by kstocke1
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 53359 byte(s)
Diff to previous 1513

new hotness

Revision 1513 - (view) (annotate) - [select for diffs]
Modified Tue Oct 19 18:40:54 2010 UTC (15 years, 1 month ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 54217 byte(s)
Diff to previous 1454

Adding an object count option to staticProps

Revision 1454 - (view) (annotate) - [select for diffs]
Modified Wed Jun 23 19:25:02 2010 UTC (15 years, 5 months ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 53151 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 (15 years, 6 months ago) by chuckv
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 50374 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 (15 years, 7 months ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 50309 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, 7 months ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 50309 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, 8 months ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 48474 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 (16 years ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 46588 byte(s)
Diff to previous 1213

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

Revision 1213 - (view) (annotate) - [select for diffs]
Modified Wed Jan 23 21:21:50 2008 UTC (17 years, 10 months ago) by xsun
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 54250 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 (18 years, 3 months ago) by chuckv
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 53274 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, 8 months ago) by chuckv
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 51112 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 (19 years, 1 month ago) by chuckv
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 46910 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 (19 years, 2 months ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 44450 byte(s)
Diff to previous 1041

Mostly done with BondOrderParameter.  Only a few performance tweaks
remain

Revision 1041 - (view) (annotate) - [select for diffs]
Modified Wed Sep 20 20:13:40 2006 UTC (19 years, 2 months ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 46095 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 (19 years, 2 months ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 45967 byte(s)
Diff to previous 980

Working on BondOrderParameter

Revision 980 - (view) (annotate) - [select for diffs]
Modified Thu Jun 1 18:06:33 2006 UTC (19 years, 6 months ago) by xsun
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 42565 byte(s)
Diff to previous 967

Add the RippleOP to calculate the orderparameter of the ripples.

Revision 967 - (view) (annotate) - [select for diffs]
Modified Mon May 22 15:30:42 2006 UTC (19 years, 6 months ago) by xsun
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 41495 byte(s)
Diff to previous 955

fixed the bugs of Hxy.cpp.

Revision 955 - (view) (annotate) - [select for diffs]
Modified Fri May 12 21:34:43 2006 UTC (19 years, 7 months ago) by xsun
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 41413 byte(s)
Diff to previous 929

Changes to calculate undulation spectrum

Revision 929 - (view) (annotate) - [select for diffs]
Modified Tue Apr 11 15:33:27 2006 UTC (19 years, 8 months ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 37573 byte(s)
Diff to previous 840

*** empty log message ***

Revision 840 - (view) (annotate) - [select for diffs]
Modified Mon Jan 9 22:14:32 2006 UTC (19 years, 11 months ago) by tim
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 17991 byte(s)
Diff to previous 545

fixing RhoZ

Revision 545 - (view) (annotate) - [select for diffs]
Modified Fri May 27 21:11:24 2005 UTC (20 years, 6 months ago) by tim
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 17275 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 (20 years, 6 months ago) by tim
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 16593 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 (20 years, 6 months ago) by tim
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 12909 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, 8 months ago) by gezelter
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 11620 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, 9 months ago) by tim
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 12282 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, 10 months ago) by tim
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 11416 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, 10 months ago) by tim
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 11357 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, 10 months ago) by tim
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 11336 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, 10 months ago) by tim
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 11414 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, 10 months ago) by tim
Original Path: trunk/src/applications/staticProps/StaticPropsCmd.c
File length: 11483 byte(s)

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