Creating busticated version of OpenMD

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/utils/interpolation.F90
File length: 10713 byte(s)
Diff to previous 1390

Adding property set to svn entries

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

Revision 983 - (view) (annotate) - [select for diffs]
Modified Tue Jun 6 17:43:28 2006 UTC (18 years, 10 months ago) by gezelter
Original Path: trunk/src/utils/interpolation.F90
File length: 10755 byte(s)
Diff to previous 960

testing GB, removing CM drift in Langevin Dynamics, fixing a memory
leak, adding a visitor

Getting fortran side prepped for single precision...

Revision 939 - (view) (annotate) - [select for diffs]
Modified Thu Apr 20 18:24:24 2006 UTC (19 years ago) by gezelter
Original Path: trunk/src/utils/interpolation.F90
File length: 10477 byte(s)
Diff to previous 938

Complete rewrite of spline code and everything that uses it.

Many performance improvements

Revision 935 - (view) (annotate) - [select for diffs]
Modified Fri Apr 14 21:59:23 2006 UTC (19 years ago) by gezelter
Original Path: trunk/src/utils/interpolation.F90
File length: 9992 byte(s)
Diff to previous 934

changed the interface a bit

added some logical flags

Revision 933 - (view) (annotate) - [select for diffs]
Modified Fri Apr 14 21:06:55 2006 UTC (19 years ago) by chrisfen
Original Path: trunk/src/utils/interpolation.F90
File length: 9519 byte(s)
Diff to previous 932

Wiped the spline with derivatives and corrected a boundary comparision error by eliminating the check.  This algorithm REQUIRES known first derivatives at the endpoints.

bug fixes for interpolation module

Revision 931 - (view) (annotate) - [select for diffs]
Added Fri Apr 14 19:57:04 2006 UTC (19 years ago) by gezelter
Original Path: trunk/src/utils/interpolation.F90
File length: 12491 byte(s)

Heavily modified interpolation module, also moved to "utils"