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DNS_analysis_main.py
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DNS_analysis_main.py
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'''
This is to read in the binary data File for the high pressure bunsen data and planar turbulent flame
use: dns_analysis_UVW -> includes the Velocity data for the post processing
@author: mhansinger
last change: April 2020
'''
import numpy as np
import pandas as pd
import matplotlib.pyplot as plt
import os
from os.path import join
import dask.dataframe as dd
from numba import jit, cuda
#from mayavi import mlab
# to free memory
import gc
import dask
import scipy as sp
import scipy.ndimage
import dask.array as da
import sys
from scipy import special, interpolate
from skimage import measure
from joblib import delayed, Parallel
import time
from progress.bar import ChargingBar
import itertools
import copy
# for numerical integration
from scipy.integrate import simps
#external cython functions
from external_cython.compute_uprime_cython import compute_U_prime_cython
from external_cython.compute_gradU_LES_4thO_cython import compute_gradU_LES_4thO_cython
from external_cython.compute_DNS_grad_4thO_cython import compute_DNS_grad_4thO_cython
from external_cython.compute_gradU_LES_4thO_tensor_cython import compute_gradU_LES_4thO_tensor_cython
from external_cython.compute_LES_grad_4thO_tensor_cython import compute_LES_grad_4thO_tensor_cython
class dns_analysis_base(object):
# Base class. To be inherited from
def __init__(self, case):
'''
# CONSTRUCTOR
:param case: case name: NX512, 1bar, 5bar or 10bar
'''
# THIS NAME IS GIVEN BY THE OUTPUT FROM FORTRAN CODE, COULD CHANGE...
self.c_by_rho_path = join(case,'rho_by_c.dat')
self.rho_path = join(case,'rho.dat')
self.c_path = join(case,'c.dat')
self.c_data_np = None
self.data_rho = None
self.case = case
# Filter width of the LES cell: is filled later
self.filter_width = None
self.every_nth = None
# gradient of c on the DNS mesh
self.grad_c_DNS = None
# gradient of c on the LES mesh
self.grad_c_LES = None
if self.case is '1bar':
# NUMBER OF DNS CELLS IN X,Y,Z DIRECTION
self.Nx = self.Ny = self.Nz = 250
# PARAMETER FOR REACTION RATE
self.bfact = 7364.0
# REYNOLDS NUMBER
self.Re = 399 #100
# DIMENSIONLESS DNS GRID SPACING, DOMAIN IS NOT UNITY
self.delta_x = 1/188
# PRESSURE [BAR]
self.p = 1
m = 4.4545
beta=6
alpha=0.81818
elif self.case=='5bar':
self.Nx = self.Ny = self.Nz = 560
self.bfact = 7128.3
self.Re = 892 # 500
self.delta_x = 1/432
self.p = 5
m = 4.4545
beta=6
alpha=0.81818
elif self.case=='10bar':
self.Nx = self.Ny = self.Nz = 795
self.bfact = 7128.3
self.Re = 1262 #1000
self.delta_x = 1/611
self.p = 10
m = 4.4545
beta=6
alpha=0.81818
elif self.case is 'dummy_planar_flame':
# this is a dummy case with 50x50x50 entries!
print('\n################\nThis is the dummy test case!\n################\n')
self.Nx = self.Ny = self.Nz = 150
self.bfact = 7364.0
self.Re = 100
self.delta_x = 1/188
self.p = 1
elif self.case.startswith('NX512'):
# check: Parameter_PlanarFlame.xlsx
self.Nx = self.Ny = self.Nz = 512
self.bfact = 3675
self.Re = 50
self.delta_x = 1/220 # Klein nochmal fragen! -> 220 stimmt!
self.p = 1
m = 4.4545
beta=6
alpha=0.81818
elif self.case is 'planar_flame_test':
# check: Parameter_PlanarFlame.xlsx
print('\n################\nThis is the laminar planar test case!\n################\n')
self.Nx = self.Ny = self.Nz = 512
self.bfact = 3675
self.Re = 50
self.delta_x = 1/220
self.p = 1
m = 4.4545
beta=6
alpha=0.81818
else:
raise ValueError('This case does not exist!\nOnly: 1bar, 5bar, 10bar\n')
# for reaction rates
self.alpha = alpha
self.beta = beta
self.m = m
# normalizing pressure
self.p_0 = 1
# Variables for FILTERING
# Reynolds filtered progress variable
self.c_bar = np.zeros((self.Nx,self.Ny,self.Nz))
#self.rho_filtered = np.zeros((self.Nx,self.Ny,self.Nz))
#self.c_bar_clipped = np.zeros((self.Nx,self.Ny,self.Nz)) # c für wrinkling factor nur zw 0.75 und 0.85
# SCHMIDT NUMBER
self.Sc = 0.7
# DELTA_LES: NORMALIZED FILTERWIDTH
self.Delta_LES = None # --> is computed in self.run_analysis !
self.gauss_kernel = None
self.filter_type = None
#Data array to store the results
self.dataArray_np = np.zeros(7)
self.data_flag = True
# checks if output directory exists
self.output_path = join(case,'output_test')
if os.path.isdir(self.output_path) is False:
os.mkdir(self.output_path)
self.col_names = ['c_tilde','rho_bar','c_rho','rho','reactionRate']
print('Case: %s' % self.case)
print('Nr. of grid points: %i' % self.Nx)
print("Re = %f" % self.Re)
print("Sc = %f" % self.Sc)
print("dx_DNS = %f" % self.delta_x)
# CONSTRUCTOR END
########################
def dask_read_transform(self):
'''
reads in the c field and stores it in self.c_data_np as np.array. 3D!!
:return: nothing
'''
print('Reading in c, rho*c, rho data...')
try:
c_data_vec = pd.read_csv(self.c_path,names=['c']).values.astype(dtype=np.float32)
self.c_data_np = c_data_vec.reshape(self.Nx,self.Ny,self.Nz)
crho_data_vec = pd.read_csv(self.c_by_rho_path,names=['rho_c']).values.astype(dtype=np.float32)
self.rho_c_data_np = crho_data_vec.reshape(self.Nx,self.Ny,self.Nz)
rho_data_vec = pd.read_csv(self.rho_path,names = ['rho']).values.astype(dtype=np.float32)
self.rho_data_np = rho_data_vec.reshape(self.Nx,self.Ny,self.Nz)
except OSError:
print('c.dat not found, compute it from rho_c.dat and rho.dat')
try:
self.data_rho_c = dd.read_csv(self.c_by_rho_path,names=['rho_c'])
except:
sys.exit('No data for C_rho')
try:
self.data_rho = dd.read_csv(self.rho_path,names = ['rho'])
except:
sys.exit('No data for rho')
# transform the data into an array and reshape it to 3D
self.rho_data_np = self.data_rho.to_dask_array(lengths=True).reshape(self.Nx,self.Ny,self.Nz).compute()
self.rho_c_data_np = self.data_rho_c.to_dask_array(lengths=True).reshape(self.Nx,self.Ny,self.Nz).compute()
# progress variable
self.c_data_np = self.rho_c_data_np / self.rho_data_np
#self.c_data_reduced_np = self.rho_c_data_np / self.rho_data_np # reduce c between 0.75 and 0.85
def apply_filter(self,data):
'''
method to filter the data array. Input needs to be 3D
Either Gauss or TopHat filter
:param data: 3D data np.array which is to filter
:return:
'''
# check if data is 3D array
try:
assert type(data) == np.ndarray
except AssertionError:
print('Only np.ndarrays are allowed in Gauss_filter!')
if len(data.shape) == 1:
data = data.reshape(self.Nx,self.Ny,self.Nz)
if self.filter_type == 'GAUSS':
self.sigma_xyz = [int(self.filter_width/2), int(self.filter_width/2) ,int(self.filter_width/2)]
data_filtered = sp.ndimage.filters.gaussian_filter(data, self.sigma_xyz, truncate=1.0, mode='reflect')
return data_filtered
elif self.filter_type == 'TOPHAT':
data_filtered = sp.ndimage.filters.uniform_filter(data, [self.filter_width,self.filter_width,self.filter_width],mode='reflect')
return data_filtered
elif self.filter_type == 'TOPHAT_REFLECT':
data_filtered = sp.ndimage.filters.uniform_filter(data, [self.filter_width,self.filter_width,self.filter_width],mode='reflect')
return data_filtered
else:
sys.exit('No fitler type provided ...')
def set_gaussian_kernel(self):
'''
Set the gaussian Kernel. Probably not used...
:return:
'''
size = int(self.filter_width)
vector = np.linspace(-self.filter_width,self.filter_width,2*self.filter_width+1)
x,y,z = np.meshgrid(vector, vector, vector)
x = x * self.delta_x
y = y * self.delta_x
z = z * self.delta_x
self.gauss_kernel = np.sqrt(12)/self.Delta_LES/np.sqrt(2*np.pi) * \
np.exp(-6*(x**2/self.Delta_LES**2 +y**2/self.Delta_LES**2 + z**2/self.Delta_LES**2))
def get_wrinkling(self,order='2nd'):
'''
computes the wrinkling factor
:param order: 2nd or 4th order
:return: wrinkling factor for the whole field
'''
if order == '2nd':
grad_DNS_filtered = self.compute_filter_DNS_grad()
grad_LES = self.compute_LES_grad()
elif order == '4th':
grad_DNS_filtered = self.compute_filter_DNS_grad_4thO()
grad_LES = self.compute_LES_grad_4thO()
else:
print('Order not defined. Only 2nd and 4th possible...')
raise NotImplementedError
#compute the wrinkling factor
print('Computing wrinkling factor ...')
self.wrinkling_factor = grad_DNS_filtered / grad_LES
#@jit(nopython=True) #, parallel=True)
def compute_DNS_grad(self):
'''
Compute the magnitude of the gradient of the DNS c-field, based on neighbour cells
2nd Order central differencing
:return: gradient of c for DNS: |\nabla grad(c)|
'''
print('Computing DNS gradients...')
# create empty array
grad_c_DNS = np.zeros([self.Nx,self.Ny,self.Nz])
# compute gradients from the boundaries away ...
for l in range(2,self.Nx-2):
for m in range(2,self.Ny-2):
for n in range(2,self.Nz-2):
this_DNS_gradX = (self.c_data_np[l+1, m, n] - self.c_data_np[l-1,m, n])/(2 * self.delta_x)
this_DNS_gradY = (self.c_data_np[l, m+1, n] - self.c_data_np[l, m-1, n]) / (2 * self.delta_x)
this_DNS_gradZ = (self.c_data_np[l, m, n+1]- self.c_data_np[l, m, n-1]) / (2 * self.delta_x)
# compute the magnitude of the gradient
this_DNS_magGrad_c = np.sqrt(this_DNS_gradX**2 + this_DNS_gradY**2 + this_DNS_gradZ**2)
grad_c_DNS[l,m,n] = this_DNS_magGrad_c
return grad_c_DNS
def compute_DNS_grad_4thO(self):
'''
Compute the magnitude of the gradient of the DNS c-field, based on neighbour cells
4th Order central differencing
:return: gradient of c for DNS: |\nabla grad(c)|
'''
print('Computing DNS gradients 4th Order...')
# create empty array
grad_c_DNS = np.zeros([self.Nx,self.Ny,self.Nz])
# compute gradients from the boundaries away ...
for l in range(2,self.Nx-2):
for m in range(2,self.Ny-2):
for n in range(2,self.Nz-2):
this_DNS_gradX = (-self.c_data_np[l+2, m, n] + 8*self.c_data_np[l+1,m, n] - 8*self.c_data_np[l-1,m, n] + self.c_data_np[l-2, m, n])/(12 * self.delta_x)
this_DNS_gradY = (-self.c_data_np[l, m+2, n] + 8*self.c_data_np[l,m+1, n] - 8*self.c_data_np[l,m-1, n] + self.c_data_np[l, m-2, n])/(12 * self.delta_x)
this_DNS_gradZ = (-self.c_data_np[l, m, n+2] + 8*self.c_data_np[l,m, n+1] - 8*self.c_data_np[l,m, n-1] + self.c_data_np[l, m, n+2])/(12 * self.delta_x)
# compute the magnitude of the gradient
this_DNS_magGrad_c = np.sqrt(this_DNS_gradX**2 + this_DNS_gradY**2 + this_DNS_gradZ**2)
grad_c_DNS[l,m,n] = this_DNS_magGrad_c
return grad_c_DNS
#@jit(nopython=True, parallel=True)
def compute_DNS_grad_reduced(self):
# # computes the flame surface area in the DNS based on gradients of c of neighbour cells
# # for the reduced c
# #width = 1
#
# print('Computing DNS gradients for c reduced...')
#
# # create empty array
# grad_c_DNS = np.zeros([self.Nx,self.Ny,self.Nz])
#
# # compute gradients from the boundaries away ...
# for l in range(1,self.Nx-1):
# for m in range(1,self.Nx-1):
# for n in range(1,self.Nx-1):
# this_DNS_gradX = (self.c_data_reduced_np[l+1, m, n] - self.c_data_reduced_np[l-1,m, n])/(2 * self.delta_x)
# this_DNS_gradY = (self.c_data_reduced_np[l, m+1, n] - self.c_data_reduced_np[l, m-1, n]) / (2 * self.delta_x)
# this_DNS_gradZ = (self.c_data_reduced_np[l, m, n+1] - self.c_data_reduced_np[l, m, n-1]) / (2 * self.delta_x)
# # compute the magnitude of the gradient
# this_DNS_magGrad_c = np.sqrt(this_DNS_gradX**2 + this_DNS_gradY**2 + this_DNS_gradZ**2)
#
# grad_c_DNS[l,m,n] = this_DNS_magGrad_c
#
# return grad_c_DNS
return NotImplementedError
#@jit(nopython=True)
def compute_LES_grad(self):
'''
Compute the magnitude of the gradient of the filtered (LES) c-field, based on neighbour cells on the DNS mesh
2nd Order central differencing
:return: gradient of c for LES: |\nabla grad(c)|
'''
print('Computing LES gradients on DNS mesh ...')
# create empty array
self.grad_c_LES = np.zeros([self.Nx, self.Ny, self.Nz])
# compute gradients from the boundaries away ...
for l in range(2,self.Nx-2):
for m in range(2,self.Ny-2):
for n in range(2,self.Nz-2):
this_LES_gradX = (self.c_bar[l + 1, m, n] - self.c_bar[l - 1, m, n]) / (2 * self.delta_x)
this_LES_gradY = (self.c_bar[l, m + 1, n] - self.c_bar[l, m - 1, n]) / (2 * self.delta_x)
this_LES_gradZ = (self.c_bar[l, m, n + 1] - self.c_bar[l, m, n - 1]) / (2 * self.delta_x)
# compute the magnitude of the gradient
this_LES_magGrad_c = np.sqrt(this_LES_gradX ** 2 + this_LES_gradY ** 2 + this_LES_gradZ ** 2)
self.grad_c_LES[l, m, n] = this_LES_magGrad_c
return self.grad_c_LES
def compute_LES_grad_4thO(self):
'''
Compute the magnitude of the gradient of the filtered (LES) c-field, based on neighbour cells on the DNS mesh
4th Order central differencing
:return: gradient of c for LES: |\nabla grad(c)|
'''
print('Computing LES 4th order gradients on DNS mesh ...')
# create empty array
self.grad_c_LES = np.zeros([self.Nx, self.Ny, self.Nz])
# compute gradients from the boundaries away ...
for l in range(2, self.Nx - 2):
for m in range(2, self.Ny - 2):
for n in range(2, self.Nz - 2):
this_LES_gradX = (-self.c_bar[l + 2, m, n] + 8*self.c_bar[l + 1, m, n] - 8*self.c_bar[l - 1, m, n] + self.c_bar[l - 2, m, n]) / (12 * self.delta_x)
this_LES_gradY = (-self.c_bar[l, m + 2, n] + 8*self.c_bar[l, m+1, n] - 8*self.c_bar[l, m-1, n] + self.c_bar[l, m-2, n]) / (12 * self.delta_x)
this_LES_gradZ = (-self.c_bar[l, m, n+2] + 8*self.c_bar[l, m, n+1] - 8*self.c_bar[l, m, n-1] + self.c_bar[l, m, n-2]) / (12 * self.delta_x)
# compute the magnitude of the gradient
this_LES_magGrad_c = np.sqrt(this_LES_gradX ** 2 + this_LES_gradY ** 2 + this_LES_gradZ ** 2)
self.grad_c_LES[l, m, n] = this_LES_magGrad_c
return self.grad_c_LES
#@jit(nopython=True)
def compute_LES_grad_reduced(self):
# # computes the flame surface area in the DNS based on gradients of c of neighbour DNS cells
#
# print('Computing LES gradients on DNS mesh for c reduced ...')
#
# # create empty array
# self.grad_c_LES = np.zeros([self.Nx, self.Ny, self.Nz])
#
# # compute gradients from the boundaries away ...
# for l in range(1, self.Nx - 1):
# for m in range(1, self.Nx - 1):
# for n in range(1, self.Nx - 1):
# this_LES_gradX = (self.c_bar_reduced[l + 1, m, n] - self.c_bar_reduced[l - 1, m, n]) / (2 * self.delta_x)
# this_LES_gradY = (self.c_bar_reduced[l, m + 1, n] - self.c_bar_reduced[l, m - 1, n]) / (2 * self.delta_x)
# this_LES_gradZ = (self.c_bar_reduced[l, m, n + 1] - self.c_bar_reduced[l, m, n - 1]) / (2 * self.delta_x)
# # compute the magnitude of the gradient
# this_LES_magGrad_c = np.sqrt(this_LES_gradX ** 2 + this_LES_gradY ** 2 + this_LES_gradZ ** 2)
#
# self.grad_c_LES[l, m, n] = this_LES_magGrad_c
#
# return self.grad_c_LES
return NotImplementedError
#@jit(nopython=True)
def compute_LES_grad_onLES(self):
'''
Compute the magnitude of the gradient of the filtered (LES) c-field, based on neighbour cells on the LES mesh
2nd Order central differencing
:return: gradient of c for LES: |\nabla grad(c)|
'''
print('Computing LES gradients on LES mesh ...')
# create empty array
self.grad_c_LES = np.zeros([self.Nx, self.Ny, self.Nz])
# compute gradients from the boundaries away ...
for l in range(self.filter_width, self.Nx - self.filter_width):
for m in range(self.filter_width, self.Ny - self.filter_width):
for n in range(self.filter_width, self.Nz - self.filter_width):
this_LES_gradX = (self.c_bar[l + self.filter_width, m, n] - self.c_bar[l - self.filter_width, m, n]) / (2 * self.delta_x * self.filter_width)
this_LES_gradY = (self.c_bar[l, m + self.filter_width, n] - self.c_bar[l, m - self.filter_width, n]) / (2 * self.delta_x * self.filter_width)
this_LES_gradZ = (self.c_bar[l, m, n + self.filter_width] - self.c_bar[l, m, n - self.filter_width]) / (2 * self.delta_x * self.filter_width)
# compute the magnitude of the gradient
this_LES_magGrad_c = np.sqrt(this_LES_gradX ** 2 + this_LES_gradY ** 2 + this_LES_gradZ ** 2)
self.grad_c_LES[l, m, n] = this_LES_magGrad_c
return self.grad_c_LES
#@jit(nopython=True)
def compute_LES_grad_onLES_reduced(self):
# # computes the flame surface area in the DNS based on gradients of c of neighbour LES cells
#
# print('Computing LES gradients on LES mesh ...')
#
# # create empty array
# self.grad_c_LES = np.zeros([self.Nx, self.Ny, self.Nz])
#
# # compute gradients from the boundaries away ...
# for l in range(self.filter_width, self.Nx - self.filter_width):
# for m in range(self.filter_width, self.Nx - self.filter_width):
# for n in range(self.filter_width, self.Nx - self.filter_width):
# this_LES_gradX = (self.c_bar_reduced[l + self.filter_width, m, n] - self.c_bar_reduced[l - self.filter_width, m, n]) / (2 * self.delta_x * self.filter_width)
# this_LES_gradY = (self.c_bar_reduced[l, m + self.filter_width, n] - self.c_bar_reduced[l, m - self.filter_width, n]) / (2 * self.delta_x * self.filter_width)
# this_LES_gradZ = (self.c_bar_reduced[l, m, n + self.filter_width] - self.c_bar_reduced[l, m, n - self.filter_width]) / (2 * self.delta_x * self.filter_width)
# # compute the magnitude of the gradient
# this_LES_magGrad_c = np.sqrt(this_LES_gradX ** 2 + this_LES_gradY ** 2 + this_LES_gradZ ** 2)
#
# self.grad_c_LES[l, m, n] = this_LES_magGrad_c
#
# return self.grad_c_LES
return NotImplementedError
def compute_isoArea(self,c_iso):
'''
Computes the flame surface iso Area in a LES cell using the MARCHING CUBES ALGORITHM
:param c_iso: define a c_iso value to compute the surface
:return: isoArea_coefficient = A_turbulent/A_planar
'''
print('Computing the surface for c_iso: ', c_iso)
# print('Currently in timing test mode!')
half_filter = int(self.filter_width/2)
# reference area of planar flame
A_planar = (self.filter_width - 1)**2
iterpoints = self.Nx * self.Ny *self.Nz
# progress bar
bar = ChargingBar('Processing', max=iterpoints)
isoArea_coefficient = np.zeros((self.Nx,self.Ny,self.Nz))
for l in range(half_filter, self.Nx - half_filter, self.every_nth):
for m in range(half_filter, self.Ny - half_filter, self.every_nth):
for n in range(half_filter, self.Nz - half_filter, self.every_nth):
this_LES_box = (self.c_data_np[l-half_filter : l+half_filter,
m-half_filter : m+half_filter,
n-half_filter : n+half_filter])
# this works only if the c_iso value is contained in my array
# -> check if array contains values above AND below iso value
if np.any(np.where(this_LES_box < c_iso)) and np.any(np.any(np.where(this_LES_box > c_iso))):
verts, faces = measure.marching_cubes_classic(this_LES_box, c_iso)
iso_area = measure.mesh_surface_area(verts=verts, faces=faces)
else:
iso_area = 0
isoArea_coefficient[l, m, n] = iso_area / A_planar
# iterbar
bar.next()
bar.finish()
return isoArea_coefficient
def compute_isoArea_dynamic(self):
'''
Computes the flame surface iso Area in a LES cell using the MARCHING CUBES ALGORITHM
based on c_bar in the respective LES cell -> dynamic definition of c_iso
:return: isoArea_coefficient = A_turbulent/A_planar
'''
print('Computing the surface for c_iso based on c_bar ')
# print('Currently in timing test mode!')
half_filter = int(self.filter_width/2)
# reference area of planar flame
A_planar = (self.filter_width - 1)**2
iterpoints = (self.Nx)**3
# progress bar
bar = ChargingBar('Processing', max=iterpoints)
isoArea_coefficient = np.zeros((self.Nx,self.Ny,self.Nz))
for l in range(half_filter, self.Nx - half_filter, self.every_nth):
for m in range(half_filter, self.Ny - half_filter, self.every_nth):
for n in range(half_filter, self.Nz - half_filter, self.every_nth):
this_LES_box = (self.c_data_np[l-half_filter : l+half_filter,
m-half_filter : m+half_filter,
n-half_filter : n+half_filter])
# compute c_bar of current LES box
this_c_bar = np.mean(this_LES_box)[0]
c_iso = this_c_bar
print('c_iso: %f' % c_iso)
# this works only if the c_iso value is contained in my array
# -> check if array contains values above AND below iso value
if np.any(np.where(this_LES_box < c_iso)) and np.any(np.any(np.where(this_LES_box > c_iso))):
verts, faces = measure.marching_cubes_classic(this_LES_box, c_iso)
iso_area = measure.mesh_surface_area(verts=verts, faces=faces)
else:
iso_area = 0
if iso_area / A_planar < 1:
isoArea_coefficient[l,m,n] = 0
else:
isoArea_coefficient[l, m, n] = iso_area / A_planar
# iterbar
bar.next()
bar.finish()
return isoArea_coefficient
# ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
# this is for the parallel approach with joblib
def compute_isoArea_parallel(self,c_iso):
print('Computing the surface for c_iso: ', c_iso)
half_filter = int(self.filter_width/2)
DNS_range = range(half_filter, self.Nx - half_filter)
isoArea_coefficient = np.zeros((self.Nx,self.Ny,self.Nz))
isoArea_list = Parallel(n_jobs=4)(delayed(self.compute_this_LES_box)(l,m,n, half_filter,c_iso,isoArea_coefficient)
for n in DNS_range
for m in DNS_range
for l in DNS_range)
# reshape isoArea_list into 3D np.array
isoArea_coefficient = np.array(isoArea_list).reshape(self.Nx,self.Ny,self.Nz)
return isoArea_coefficient
def compute_this_LES_box(self,l,m,n, half_filter,c_iso,isoArea_coefficient):
this_LES_box = (self.c_data_np[l - half_filter: l + half_filter,
m - half_filter: m + half_filter,
n - half_filter: n + half_filter])
# this works only if the c_iso value is contained in my array
# -> check if array contains values above AND below iso value
try: #if np.any(np.where(this_LES_box < c_iso)) and np.any(np.any(np.where(this_LES_box > c_iso))):
verts, faces = measure.marching_cubes_classic(this_LES_box, c_iso)
iso_area = measure.mesh_surface_area(verts=verts, faces=faces)
except ValueError: #else:
iso_area = 0
#isoArea_coefficient[l, m, n] = iso_area / (self.filter_width - 1) ** 2
return iso_area / (self.filter_width - 1) ** 2
# ~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~
def compute_filter_DNS_grad(self):
'''
Filters the DNS gradients
2nd Order
:return: grad_DNS_filtered
'''
# compute dask delayed object
grad_c_DNS = self.compute_DNS_grad()
grad_DNS_filtered = self.apply_filter(grad_c_DNS)
return grad_DNS_filtered
def compute_filter_DNS_grad_4thO(self):
'''
Filters the DNS gradients
4th Order
:return: grad_DNS_filtered
'''
# compute dask delayed object
grad_c_DNS = self.compute_DNS_grad_4thO()
grad_DNS_filtered = self.apply_filter(grad_c_DNS)
return grad_DNS_filtered
def compute_filter_DNS_grad_reduced(self):
# # compute filtered DNS reaction rate
#
# # compute dask delayed object
# grad_c_DNS = self.compute_DNS_grad_reduced()
#
# grad_DNS_filtered = self.apply_filter(grad_c_DNS)
#
# return grad_DNS_filtered
return NotImplementedError
def compute_RR_DNS(self):
'''
Computes the reaction rate of the DNS data.
See Pfitzner, FTC, 2019, Eq. 4, with Lambda = 18.97
:return: omega_DNS
'''
Lambda = 18.97
c_data_np_vector = self.c_data_np.reshape(self.Nx*self.Ny*self.Nz)
# according to Pfitzner implementation
exponent = - self.beta*(1 - c_data_np_vector) / (1 - self.alpha*(1 - c_data_np_vector))
this_RR_reshape_DNS_Pfitz = Lambda * ((1 - self.alpha * (1 - c_data_np_vector))) ** (-1) \
* (1 - c_data_np_vector) * np.exp(exponent)
# reshape it to 3D array
RR_DNS = this_RR_reshape_DNS_Pfitz.reshape(self.Nx,self.Ny,self.Nz)
return RR_DNS
def filter_RR_DNS(self):
'''
Filters the DNS reaction rates
:return: omega_DNS_filtered
'''
RR_DNS_filtered = self.apply_filter(self.omega_DNS)
return RR_DNS_filtered
def compute_RR_LES(self):
'''
Computes the filtered reaction rates based on the filtered c field (c_bar)
See Pfitzner, FTC, 2019, Eq. 4, with Lambda = 18.97
:return: omega_LES
'''
Lambda = 18.97
# according to Pfitzner implementation
exponent = - self.beta*(1-self.c_bar.reshape(self.Nx*self.Ny*self.Nz)) / (1 - self.alpha*(1 - self.c_bar.reshape(self.Nx*self.Ny*self.Nz)))
#this_RR_reshape_DNS = self.bfact*self.rho_data_np.reshape(self.Nx*self.Ny*self.Nz)*(1-self.c_data_np.reshape(self.Nx*self.Ny*self.Nz))*np.exp(exponent)
this_RR_reshape_LES_Pfitz = Lambda * ((1 - self.alpha * (1 - self.c_data_np.reshape(self.Nx*self.Ny*self.Nz)))) ** (-1) \
* (1 - self.c_data_np.reshape(self.Nx*self.Ny*self.Nz)) * np.exp(exponent)
# reshape it to 3D array
RR_LES = this_RR_reshape_LES_Pfitz.reshape(self.Nx,self.Ny,self.Nz)
return RR_LES
# added Nov. 2018: Implementation of Pfitzner's analytical boundaries
# getter and setter for c_Mean as a protected
def compute_flamethickness(self):
'''
Copmutes the flame thicknes
See Pfitzner, FTC, 2019, Eq. 17 according to analytical model (not numerical!)
:param m:
:return: flame thicknes dth
'''
return (self.m + 1) ** (1 / self.m + 1) / self.m
# compute self.delta_x_0
def compute_delta_0(self,c):
'''
See Pfitzner, FTC, 2019, Eq. 38
:param c: usually c_0
:param m: steepness of the flame front; not sure how computed
:return: computes self.delta_x_0, needed for c_plus and c_minus
'''
return (1 - c ** self.m) / (1-c)
def compute_c_m(self,xi):
'''
computes c_m
See Pfitzner, FTC, 2019, Eq. 12
:param xi: transformed coordinate
:return: c_m
'''
return (1 + np.exp(- self.m * xi)) ** (-1 / self.m)
def compute_xi_m(self,c):
'''
computes xi_m
See Pfitzner, FTC, 2019, Eq. 13
:param c: c progress variable
:return: xi_m
'''
return 1 / self.m * np.log(c ** self.m / (1 - c ** self.m))
def compute_s(self,c):
'''
See Pfitzner, FTC, 2019, Eq. 39
:param c: progress variable
:param Delta_LES: Delta_LES (scaled filter width)
:return: s
'''
s = np.exp( - self.Delta_LES / 7) * ((np.exp(self.Delta_LES / 7) - 1) * np.exp(2 * (c - 1) * self.m) + c)
return s
# compute the values for c_minus
def compute_c_minus(self):
'''
compute c_minus field and update self.c_minus array
See Pfitzner, FTC, 2019, Eq. 40
:return: nothing
'''
# self.c_bar.reshape(self.Nx*self.Ny*self.Nz) = c_bar in der ganzen domain als vector
this_s = self.compute_s(self.c_bar.reshape(self.Nx*self.Ny*self.Nz))
this_delta_0 = self.compute_delta_0(this_s)
self.c_minus = (np.exp(self.c_bar.reshape(self.Nx*self.Ny*self.Nz)* this_delta_0 * self.Delta_LES) - 1) / \
(np.exp(this_delta_0 * self.Delta_LES) - 1)
# Analytical c_minus (Eq. 35)
def compute_c_minus_analytical(self):
'''
Analytical approximation to obtain c_minus. Updates self.c_minus and self.c_plus array
See Pfitzner, FTC,2019, Eq. 35
:return: nothing
'''
# generate a dummy c_minus vector
c_minus_dummy = np.linspace(0,0.99999,100000)
# compute c_plus
this_xi_m = self.compute_xi_m(c_minus_dummy)
xi_plus_Delta = this_xi_m + self.Delta_LES
c_plus_dummy = self.compute_c_m(xi_plus_Delta)
# compute upper bound profile based on c_bar_dumma
upper_bound = self.I_1(c_plus_dummy)
lower_bound = self.I_1(c_minus_dummy)
c_bar_dummy = (upper_bound - lower_bound) # /self.Delta_LES # nicht sicher Delta_LES
# interpolate from c_minus_profile to correct c_minus based on c_filtered
f_c_minus = interpolate.interp1d(c_bar_dummy, c_minus_dummy,fill_value="extrapolate")
f_c_plus = interpolate.interp1d(c_bar_dummy, c_plus_dummy, fill_value="extrapolate")
# update c_minus and c_plus
self.c_minus = f_c_minus(self.c_bar.reshape(self.Nx*self.Ny*self.Nz))
self.c_plus = f_c_plus(self.c_bar.reshape(self.Nx*self.Ny*self.Nz))
def I_1(self,c):
'''
See Pfitzner, FTC, 2019, Eq. 35
:param c:
:return: Hypergeometric function
'''
return c / self.Delta_LES * special.hyp2f1(1, 1 / self.m, 1 + 1 / self.m, c ** self.m)
def compute_c_plus(self):
'''
Update self.c_plus field
See Pfitzner, FTC, 2019, Eq. 13
:param c: c_minus
:return: nothing
'''
this_xi_m = self.compute_xi_m(self.c_minus)
xi_plus_Delta = this_xi_m + self.Delta_LES
self.c_plus = self.compute_c_m(xi_plus_Delta)
def compute_model_omega_bar(self):
'''
:param c_plus:
:param c_minus:
:param Delta:
:return: omega Eq. 29
'''
print('Computing omega model ...')
omega_cbar = ((self.c_plus ** (self.m + 1) - self.c_minus ** (self.m + 1)) / self.Delta_LES)
# reshape to 3D array
return omega_cbar.reshape(self.Nx,self.Ny,self.Nz)
def model_omega(self,c):
'''
Analytical model for flat flame source term omega_model
See Pfitzner, FTC, Eq. 14
:param c:
:return: omega_model planar
'''
return (self.m + 1) * (1 - c ** self.m) * c ** (self.m + 1)
def analytical_omega(self, c):
'''
Analytical omega source term based on c value
Similar to method 'compute_RR_DNS' but does not apply to whole c field
See Pfitzner, FTC, Eq. 4
:param c: progress variable
:return: computes the analytical omega for given c_bar!
'''
Lambda = 18.97
print('Computing omega DNS ...')
exponent = - (self.beta * (1 - c)) / (1 - self.alpha * (1 - c))
# om_Klein = self.bfact*self.rho_bar*(1-c)*np.exp(exponent)
om_Pfitzner = Lambda * ((1 - self.alpha * (1 - c))) ** (-1) * (1 - c) * np.exp(exponent)
return om_Pfitzner
def compute_Pfitzner_model(self):
'''
Sequential computation to obtain omega_model
See Pfitzner, FTC, 2019 for more details
:param self.omega_model_cbar: is the modeled omega from the laminar planar flame
:param self.omega_DNS: is the (real) omega field from the DNS data
:param self.omega_DNS_filtered: is the filtered omega field from DNS data; this is the bench mark to compare with
:return nothing
'''
# switch between the computation modes
if self.c_analytical is True: #--> seems to be better
self.compute_c_minus_analytical()
else:
self.compute_c_minus()
self.compute_c_plus()
self.omega_model_cbar = self.compute_model_omega_bar()
#self.omega_model_cbar = self.model_omega(self.c_bar.reshape(self.Nx*self.Ny*self.Nz))
self.omega_DNS = self.analytical_omega(self.c_data_np.reshape(self.Nx*self.Ny*self.Nz))
if len(self.omega_DNS.shape) == 1:
self.omega_DNS = self.omega_DNS.reshape(self.Nx,self.Ny,self.Nz)
# filter the DNS reaction rate
print('Filtering omega DNS ...')
self.omega_DNS_filtered = self.apply_filter(self.omega_DNS)
#####################################################
class dns_analysis_wrinkling(dns_analysis_base):
#@jit(nopython=True, parallel=True)
def run_analysis_wrinkling(self,filter_width ,filter_type, c_analytical=False, Parallel=False, every_nth=1):
'''
:param filter_width: DNS points to filter
:param filter_type: use 'TOPHAT' rather than 'GAUSSIAN
:param c_analytical: compute c minus analytically
:param Parallel: use False
:param every_nth: every nth DNS point to compute the isoArea
:return:
'''
# run the analysis and compute the wrinkling factor -> real 3D cases
# interval is like nth point, skips some nodes
self.filter_type = filter_type
# joblib parallel computing of c_iso
self.Parallel = Parallel
self.every_nth = int(every_nth)
print('You are using %s filter!' % self.filter_type)
self.filter_width = int(filter_width)
self.c_analytical = c_analytical
if self.c_analytical is True:
print('You are using Hypergeometric function for c_minus (Eq.35)!')
# filter the c and rho field
print('Filtering c field ...')
#self.rho_filtered = self.apply_filter(self.rho_data_np)
self.c_bar = self.apply_filter(self.c_data_np)
# Compute the scaled Delta (Pfitzner PDF)
self.Delta_LES = self.delta_x * self.filter_width * self.Sc * self.Re * np.sqrt(self.p/self.p_0)
print('Delta_LES is: %.3f' % self.Delta_LES)
flame_thickness = self.compute_flamethickness()
print('Flame thickness: ',flame_thickness)
#maximum possible wrinkling factor
print('Maximum possible wrinkling factor: ', self.Delta_LES/flame_thickness)
# Set the Gauss kernel
self.set_gaussian_kernel()
# compute the wrinkling factor
self.get_wrinkling()
self.compute_Pfitzner_model()
#c_bins = self.compute_c_binning(c_low=0.8,c_high=0.9)
start = time.time()
if self.Parallel is True:
isoArea_coefficient = self.compute_isoArea_parallel(c_iso=0.85)
else:
isoArea_coefficient = self.compute_isoArea(c_iso=0.85)
#isoArea_coefficient = self.compute_isoArea_dynamic()
end=time.time()
print('computation of c_iso took %i sec: ' % int(end - start))
# write the filtered data of the whole DNS cube only if every data point is filtered. No sparse data...(every_nth > 1)