From a549778bfece819cf0b599168c571e400e6eb67d Mon Sep 17 00:00:00 2001 From: Samo Penic <samo.penic@fe.uni-lj.si> Date: Wed, 10 Sep 2014 07:03:15 +0000 Subject: [PATCH] Added calculation of epsV. --- src/tape | 24 ++++++++++++++++++------ 1 files changed, 18 insertions(+), 6 deletions(-) diff --git a/src/tape b/src/tape index e7e42e7..b0ac65c 100644 --- a/src/tape +++ b/src/tape @@ -14,11 +14,16 @@ # (pswitch=1: calc. p*dV energy contribution) pswitch = 0 # pressure difference: p_inside - p_outside (in units kT/l_min^3): -pressure=-2.0 +pressure=0.0 + +#Constant volume constraint (0 disable constant volume, 1 enable) +constvolswitch=1 +constvolprecision=1e-14 + ####### Polymer (brush) definitions ########### # npoly is a number of polymers attached to npoly distinct vertices on vesicle -npoly=0 +npoly=500 # nmono is a number of monomers in each polymer nmono=10 # Spring constant between monomers of the polymer @@ -26,15 +31,15 @@ ####### Filament (inside the vesicle) definitions ########### # nfil is a number of filaments inside the vesicle -nfil=2 +nfil=0 # nfono is a number of monomers in each filament nfono=300 # Persistence lenght of the filaments (in units l_min) -xi=100 +xi=0 ####### Nucleus (inside the vesicle) ########### # Radius of an impenetrable hard sphere inside the vesicle -R_nucleus=5 +R_nucleus=0 ####### Cell definitions ############ nxmax=60 @@ -44,13 +49,20 @@ ####### Program Control ############ #how many MC sweeps between subsequent records of states to disk -mcsweeps=1000 +#200000 +mcsweeps=20 #how many initial mcsweeps*inititer MC sweeps before recording to disk? +#2 inititer=0 #how many records do you want on the disk iteration are there in a run? +#10000 iterations=100 +###### Spherical harmonics ########### +# If 0 then spherical harmonics are not calculated at all. +spherical_harmonics_coefficients=21 + #shut up if we are using cluster!!! quiet=false -- Gitblit v1.9.3