zhyang-dev/LPP
1
0
Fork 0
mirror of https://github.com/ParticulateFlow/LPP.git synced 2025-12-08 06:37:46 +00:00
Code Issues Actions Packages Projects Releases Wiki Activity

convert tabs to spaces, remove extra spaces, fix comments

Browse Source
This commit is contained in:
danielque
2023-08-09 16:49:09 +02:00
parent 633058e1ab
commit d560b34214
47 changed files with 1263 additions and 1266 deletions
Download Patch File Download Diff File Expand all files Collapse all files

30
scripts/flux.py
View File

@ -1,4 +1,4 @@
#!/usr/bin/python
#!/usr/bin/python
# Script: flux.py
# Purpose: flux of atoms through a user-defined plane
@ -41,38 +41,38 @@ flag = 0
while 1:
which,time,flag = d.iterator(flag)
if flag == -1: break
if direction == "x":
id,type,x = d.vecs(time,"id","type","x")
lo = d.snaps[which].xlo
hi = d.snaps[which].xhi
elif direction == "y":
id,type,x = d.vecs(time,"id","type","y")
lo = d.snaps[which].ylo
hi = d.snaps[which].yhi
elif direction == "z":
lo = d.snaps[which].ylo
hi = d.snaps[which].yhi
elif direction == "z":
id,type,x = d.vecs(time,"id","type","z")
lo = d.snaps[which].zlo
hi = d.snaps[which].zhi
prd = hi - lo
plane = lo + scaled_plane*prd
lo = d.snaps[which].zlo
hi = d.snaps[which].zhi
prd = hi - lo
plane = lo + scaled_plane*prd
print time,
sys.stdout.flush()
natoms = len(x)
if jconfig == 0: x_initial = (natoms+1) * [0]
jconfig += 1
typeflux = ntypes * [0]
for i in xrange(natoms):
id[i] = int(id[i])
type[i] = int(type[i])
if jconfig == 1: x_initial[id[i]] = x[i]
if x_initial[id[i]] < plane and x[i] > plane :
crossings = int((x[i] - plane)/prd) + 1
crossings = int((x[i] - plane)/prd) + 1
typeflux[type[i]] += crossings
elif x_initial[id[i]] > plane and x[i] < plane :
crossings = int((plane - x[i])/prd) + 1
@ -83,5 +83,5 @@ while 1:
print >>f,typeflux[j+1],
print >>f
print
f.close()