Re: Effective damping program

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Gavin Abo

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Jul 2, 2026, 7:40:48 PM (20 hours ago) Jul 2
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Hi,

I don't believe the time-series is needed.

When you use the effective-damping, it does the equilibration, 30 degree rotation, and the time-series.  At least, that is what the source code is showing:

effective-damping.pn

I did try to reproduce FIG. 3 (a) but didn't have much luck in doing so as seen by the following plot:

MvsTime.png

In that plot, even my graphing of the analytic equations (9) for My and Mz don't look quite right.

It may be worth mentioning, though, that I used a VAMPIRE 7.0.0 develop version and haven't tried it yet using VAMPIRE 5.0 that was mentioned in the paper [1].

One notable feature of FIG. 3 (a) in [1] is that it looks like it was plotted to exclude the equilibration phase of the simulation, whereas I left that in I my plot above.  On the other hand, the equilibration phase is shown for FIG. 5 of the same paper at [1], where it looks like they must have shifted the outputted simulation time so that t = 0 picoseconds corresponds with the end of the equilibration phase.

I hope that will help you at least a little bit.

username@computername:~/effective-damping$ ls -l
total 12
-rw-r--r-- 1 username username 1198 Jul  2 10:08 CoFeB.mat
-rw-r--r-- 1 username username 1283 Jul  2 16:00 input
-rw-r--r-- 1 username username  617 Jul  2 16:07 plotm
username@computername:~/effective-damping$ mpirun -np 4 ~/vampire/vampire-parallel 
Processor 2 of 4 online on host computername
Processor 3 of 4 online on host computername
Processor 4 of 4 online on host computername
                                                _          
                                               (_)         
                    __   ____ _ _ __ ___  _ __  _ _ __ ___ 
                    \ \ / / _` | '_ ` _ \| '_ \| | '__/ _ \
                     \ V / (_| | | | | | | |_) | | | |  __/
                      \_/ \__,_|_| |_| |_| .__/|_|_|  \___|
                                         | |               
                                         |_|               

                      Version 7.0.0 Jun 21 2026 20:55:03

             Git commit: 8707dedc7997cb60c06bb2efee2d64b9f6570a19

  Licensed under the GNU Public License(v2). See licence file for details.

  Developers:   Richard F L Evans, Sarah Jenkins, Andrea Meo, 
                Daniel Meilak, Andrew Naden, Matthew Ellis,
                Oscar Arbelaez, Sam Morris, Rory Pond, Weijia Fan,
                Phanwadee Chureemart, Pawel Sobieszczyk, Joe Barker, 
                Thomas Ostler, Andreas Biternas, Roy W Chantrell,
                Wu Hong-Ye, Razvan Ababei, Sam Westmoreland,
                Milton Persson
 
                Compiler Flags: MPI 

  Vampire includes a copy of the qhull library from C.B. Barber and The 
  Geometry Center and may be obtained via http from www.qhull.org.

================================================================================
Thu Jul  2 16:00:56 2026
Processor 1 of 4 online on host computername
================================================================================
Initialising system variables
Creating system
System decomposed into 2 x 2 x 1 processors for parallel execution
Copying halo atoms to other processors...done!
Generating neighbour list..........done!
Initialising MPI communications...done!
Copying system data to optimised data structures.
Using generic/normalised form of exchange interaction with 16 total interactions.
Total number of atoms (all CPUs): 68600
Initialising dipole field calculation using macrocell solver
Dipole field calculation requires 12.7008 MB of RAM
Total memory for dipole calculation (all CPUs): 84.0158 MB of RAM
Precalculating rij matrix for dipole calculation using macrocell solver..........done! [ 0.0188029 s ]
Time for initialisation: 0.435503
Starting Simulation with Program effective-damping...
Simulation run time [s]: 2790.9
Simulation ended gracefully.
username@computername:~/effective-damping$ gnuplot --persist plotm

[1] https://www-users.york.ac.uk/~rfle500/resources/paper_70.pdf

Kind Regards,

Gavin
VAMPIRE user

On 7/1/2026 6:04 AM, Vinod Naik Bhukya wrote:
 PHYSICAL REVIEW APPLIED 11, 044001 (2019) 
In this paper, it was mentioned that "  The system is first equilibrated with a 10 T applied field along the z axis. A uniform rotation of the thermally equilibrated spin configuration is then made to initialize the magnetization to an angle of 30◦ in the y-z plane."  

My doubt is
1. Do we need to first run a time-series program with temperature 300, and 10T magnetic field applied in Z direction, and save the checkpoint using sim:save-checkpoint=end?

2. Now the spin configuration is thermally equilibrated, and we run the second program which is effective damping.
" A uniform rotation of the thermally equilibrated spin configuration is then made to initialize the magnetization to an angle of 30◦ in the y-z plane" how do we do this? just by changing the initial spin configuration in the material file? then what's the point of checkpoint?

Vinod Naik Bhukya 在 2026年7月1日 星期三下午6:43:28 [UTC+8] 的信中寫道:
Dear vampire users,

Please help me with effective damping program. If someone has a input file on how to simulate for effective damping , it would be appreciable. 
My doubt is do we need to use both 'time-series' as well as 'effective-damping' programs and what are all the simulation attributes we need to mention in the input file?

Thank you.
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CoFeB.mat
input
plotm

Vinod Naik Bhukya

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Jul 2, 2026, 8:37:03 PM (19 hours ago) Jul 2
to Gavin Abo, vampir...@googlegroups.com
Yeah I got that after I posted. I understood. Thank you.


Best Regards,

Vinod ()

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Vinod Naik Bhukya

Student Office: EF751-B

Dual Degree Ph.D. student (Indian Institute of Technology Kanpur)

International College of Semiconductor Technology (ICST)

National Yang-Ming Chiao-Tung University (NYCU), Hsinchu, Taiwan.

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