From 49b13dbe400c43e88f16253e8402593dfa4471d0 Mon Sep 17 00:00:00 2001
From: David <forenkram@gmx.de>
Date: Tue, 23 Jun 2020 16:27:08 +0200
Subject: [PATCH] split interface 45 into a and b to avoid rogue dof

---
 ..._patch-realistic-different-model-change.py |   0
 ...soil_with_inner_patch-realistic-pure-dd.py |   0
 ...layered_soil_with_inner_patch-realistic.py |   0
 .../TP-TP-layered_soil_with_inner_patch.py    | 120 +--
 ...istic-different-model-change_mesh_study.py |   0
 ...nner_patch-realistic-pure-dd_mesh_study.py |   0
 ...ayered_soil_with_inner_patch_mesh_study.py | 987 +++++++++++++-----
 7 files changed, 762 insertions(+), 345 deletions(-)
 rename Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/{ => Archive}/TP-TP-layered_soil_with_inner_patch-realistic-different-model-change.py (100%)
 rename Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/{ => Archive}/TP-TP-layered_soil_with_inner_patch-realistic-pure-dd.py (100%)
 rename Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/{ => Archive}/TP-TP-layered_soil_with_inner_patch-realistic.py (100%)
 rename Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/{ => Archive}/TP-TP-layered_soil_with_inner_patch-realistic-different-model-change_mesh_study.py (100%)
 rename Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/{ => Archive}/TP-TP-layered_soil_with_inner_patch-realistic-pure-dd_mesh_study.py (100%)

diff --git a/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/TP-TP-layered_soil_with_inner_patch-realistic-different-model-change.py b/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/Archive/TP-TP-layered_soil_with_inner_patch-realistic-different-model-change.py
similarity index 100%
rename from Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/TP-TP-layered_soil_with_inner_patch-realistic-different-model-change.py
rename to Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/Archive/TP-TP-layered_soil_with_inner_patch-realistic-different-model-change.py
diff --git a/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/TP-TP-layered_soil_with_inner_patch-realistic-pure-dd.py b/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/Archive/TP-TP-layered_soil_with_inner_patch-realistic-pure-dd.py
similarity index 100%
rename from Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/TP-TP-layered_soil_with_inner_patch-realistic-pure-dd.py
rename to Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/Archive/TP-TP-layered_soil_with_inner_patch-realistic-pure-dd.py
diff --git a/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/TP-TP-layered_soil_with_inner_patch-realistic.py b/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/Archive/TP-TP-layered_soil_with_inner_patch-realistic.py
similarity index 100%
rename from Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/TP-TP-layered_soil_with_inner_patch-realistic.py
rename to Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/Archive/TP-TP-layered_soil_with_inner_patch-realistic.py
diff --git a/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/TP-TP-layered_soil_with_inner_patch.py b/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/TP-TP-layered_soil_with_inner_patch.py
index 7f57d61..5a4362c 100755
--- a/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/TP-TP-layered_soil_with_inner_patch.py
+++ b/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/TP-TP-layered_soil_with_inner_patch.py
@@ -36,7 +36,7 @@ thisfile = "TP-TP-layered_soil_with_inner_patch.py"
 
 # GENERAL SOLVER CONFIG  ######################################################
 # maximal iteration per timestep
-max_iter_num = 300
+max_iter_num = 1000
 FEM_Lagrange_degree = 1
 
 # GRID AND MESH STUDY SPECIFICATIONS  #########################################
@@ -46,8 +46,8 @@ resolutions = {
                 # 2: 1e-6,
                 # 4: 1e-6,
                 # 8: 1e-6,
-                # 16: 5e-6,
-                32: 8e-6,
+                16: 8e-6,
+                # 32: 8e-6,
                 # 64: 2e-6,
                 # 128: 1e-6,
                 # 256: 1e-6,
@@ -61,23 +61,23 @@ timestep_size = 0.001
 number_of_timesteps = 5
 
 # LDD scheme parameters  ######################################################
-Lw1 = 0.5  # /timestep_size
-Lnw1 = 0.025
+Lw1 = 0.25  # /timestep_size
+Lnw1 = 0.25
 
-Lw2 = 0.5  # /timestep_size
-Lnw2 = 0.025
+Lw2 = 0.25  # /timestep_size
+Lnw2 = 0.25
 
-Lw3 = 0.5  # /timestep_size
-Lnw3 = 0.025
+Lw3 = 0.25 # /timestep_size
+Lnw3 = 0.25
 
-Lw4 = 0.5  # /timestep_size
-Lnw4 = 0.025
+Lw4 = 0.25  # /timestep_size
+Lnw4 = 0.25
 
-Lw5 = 0.5  # /timestep_size
-Lnw5 = 0.025
+Lw5 = 0.25  # /timestep_size
+Lnw5 = 0.25
 
-Lw6 = 0.5  # /timestep_size
-Lnw6 = 0.025
+Lw6 = 0.25  # /timestep_size
+Lnw6 = 0.25
 
 lambda12_w = 4
 lambda12_nw = 4
@@ -106,7 +106,7 @@ lambda46_nw = 4
 lambda56_w = 4
 lambda56_nw = 4
 
-include_gravity = True
+include_gravity = False
 debugflag = True
 analyse_condition = False
 
@@ -161,7 +161,7 @@ output_string = "./output/{}-{}_timesteps{}_P{}".format(
     )
 
 
-# DOMAIN AND INTERFACE  #######################################################
+# DOMAIN AND INTERFACES  #######################################################
 # global domain
 subdomain0_vertices = [df.Point(-1.0,-1.0), #
                         df.Point(1.0,-1.0),#
@@ -211,14 +211,18 @@ interface56_vertices = [interface46_vertices[1],
 
 interface34_vertices = [interface36_vertices[1],
                         interface23_vertices[2]]
-# interface36
 
-interface45_vertices = [interface56_vertices[0],
-                        df.Point(0.7, -0.2),
+# Interface 45 needs to be split, because of the shape. There can be triangles
+# with two facets on the interface and this creates a rogue dof type error when
+# integrating over that particular interface. Accordingly, the lambda_param
+# dictionary has two entries for that interface.
+interface45_vertices_a = [interface56_vertices[0],
+                        df.Point(0.7, -0.2),#df.Point(0.7, -0.2),
+                        ]
+interface45_vertices_b = [df.Point(0.7, -0.2),#df.Point(0.7, -0.2),
                         interface25_vertices[0]
                         ]
 
-
 # interface_vertices introduces a global numbering of interfaces.
 interface_def_points = [interface12_vertices,
                         interface23_vertices,
@@ -226,11 +230,11 @@ interface_def_points = [interface12_vertices,
                         interface25_vertices,
                         interface34_vertices,
                         interface36_vertices,
-                        interface45_vertices,
+                        interface45_vertices_a,
+                        interface45_vertices_b,
                         interface46_vertices,
                         interface56_vertices,
                         ]
-
 adjacent_subdomains = [[1,2],
                        [2,3],
                        [2,4],
@@ -238,6 +242,7 @@ adjacent_subdomains = [[1,2],
                        [3,4],
                        [3,6],
                        [4,5],
+                       [4,5],
                        [4,6],
                        [5,6]
                        ]
@@ -247,18 +252,17 @@ subdomain1_vertices = [interface12_vertices[0],
                         interface12_vertices[1],
                         interface12_vertices[2],
                         interface12_vertices[3],
-                        interface12_vertices[4],  # southern boundary, 12 interface
-                        subdomain0_vertices[2],  # eastern boundary, outer boundary
-                        subdomain0_vertices[3]]  # northern boundary, outer on_boundary
+                        interface12_vertices[4], # southern boundary, 12 interface
+                        subdomain0_vertices[2], # eastern boundary, outer boundary
+                        subdomain0_vertices[3]] # northern boundary, outer on_boundary
 
 # vertex coordinates of the outer boundaries. If it can not be specified as a
-# polygon, use an entry per boundary polygon.
-# This information is used for defining
+# polygon, use an entry per boundary polygon. This information is used for defining
 # the Dirichlet boundary conditions. If a domain is completely internal, the
 # dictionary entry should be 0: None
 subdomain1_outer_boundary_verts = {
-    0: [subdomain1_vertices[4],
-        subdomain1_vertices[5],  # eastern boundary, outer boundary
+    0: [subdomain1_vertices[4], #
+        subdomain1_vertices[5], # eastern boundary, outer boundary
         subdomain1_vertices[6],
         subdomain1_vertices[0]]
 }
@@ -268,12 +272,12 @@ subdomain2_vertices = [interface23_vertices[0],
                         interface23_vertices[1],
                         interface23_vertices[2],
                         interface24_vertices[1],
-                        interface25_vertices[1],  # southern boundary, 23 interface
-                        subdomain1_vertices[4],  # eastern boundary, outer boundary
+                        interface25_vertices[1], # southern boundary, 23 interface
+                        subdomain1_vertices[4], # eastern boundary, outer boundary
                         subdomain1_vertices[3],
                         subdomain1_vertices[2],
                         subdomain1_vertices[1],
-                        subdomain1_vertices[0] ]  # northern boundary, 12 interface
+                        subdomain1_vertices[0] ] # northern boundary, 12 interface
 
 subdomain2_outer_boundary_verts = {
     0: [subdomain2_vertices[9],
@@ -301,7 +305,8 @@ subdomain3_outer_boundary_verts = {
 # subdomain3
 subdomain4_vertices = [interface46_vertices[0],
                        interface46_vertices[1],
-                       interface45_vertices[1],
+                       # interface45_vertices[1],
+                       interface45_vertices_a[1],
                        interface24_vertices[1],
                        interface24_vertices[0],
                        interface34_vertices[1]
@@ -314,10 +319,11 @@ subdomain5_vertices = [interface56_vertices[0],
                        interface56_vertices[2],
                        interface25_vertices[1],
                        interface25_vertices[0],
-                       interface45_vertices[1],
-                       interface45_vertices[0]
+                       interface45_vertices_b[1],
+                       interface45_vertices_b[0]
 ]
 
+
 subdomain5_outer_boundary_verts = {
     0: [subdomain5_vertices[2],
         subdomain5_vertices[3]]
@@ -450,32 +456,34 @@ L = {
 #                         interface25_vertices,
 #                         interface34_vertices,
 #                         interface36_vertices,
-#                         interface45_vertices,
+#                         interface45_vertices_a,
+#                         interface45_vertices_b,
 #                         interface46_vertices,
 #                         interface56_vertices,
 #                         ]
 lambda_param = {
     0: {'wetting': lambda12_w,
-         'nonwetting': lambda12_nw},#
+         'nonwetting': lambda12_nw},
     1: {'wetting': lambda23_w,
-         'nonwetting': lambda23_nw},#
+         'nonwetting': lambda23_nw},
     2: {'wetting': lambda24_w,
-         'nonwetting': lambda24_nw},#
+         'nonwetting': lambda24_nw},
     3: {'wetting': lambda25_w,
-         'nonwetting': lambda25_nw},#
+         'nonwetting': lambda25_nw},
     4: {'wetting': lambda34_w,
-         'nonwetting': lambda34_nw},#
+         'nonwetting': lambda34_nw},
     5: {'wetting': lambda36_w,
-         'nonwetting': lambda36_nw},#
+         'nonwetting': lambda36_nw},
     6: {'wetting': lambda45_w,
-         'nonwetting': lambda45_nw},#
-    7: {'wetting': lambda46_w,
-         'nonwetting': lambda46_nw},#
-    8: {'wetting': lambda56_w,
-         'nonwetting': lambda56_nw},#
+         'nonwetting': lambda45_nw},
+    7: {'wetting': lambda45_w,
+         'nonwetting': lambda45_nw},
+    8: {'wetting': lambda46_w,
+         'nonwetting': lambda46_nw},
+    9: {'wetting': lambda56_w,
+         'nonwetting': lambda56_nw},
 }
 
-
 # after Lewis, see pdf file
 intrinsic_permeability = {
     1: 0.01,  # sand
@@ -853,19 +861,13 @@ p_e_sym = {
     2: {'wetting': -6.0 - (1.0 + t*t)*(1.0 + x*x + y*y),
         'nonwetting': (-1 -t*(1.1 + y + x**2)) },
     3: {'wetting': (-6.0 - (1.0 + t*t)*(1.0 + x*x)),
-        'nonwetting': (-1 -t*(1.0 + x**2) - sym.sqrt(2+t**2)*(1+y)*y**2) },
+        'nonwetting': (-1 -t*(1.0 + x**2) - sym.sin(2+t**2)*y**2) },
     4: {'wetting': (-6.0 - (1.0 + t*t)*(1.0 + x*x)),
-        'nonwetting': (-1 -t*(1.0 + x**2) - sym.sqrt(2+t**2)*(1+y)*y**2) },
+        'nonwetting': (-1 -t*(1.0 + x**2) - sym.sin(2+t**2)*y**2) },
     5: {'wetting': (-6.0 - (1.0 + t*t)*(1.0 + x*x)),
-        'nonwetting': (-1 -t*(1.0 + x**2) - sym.sqrt(2+t**2)*(1+y)*y**2) },
+        'nonwetting': (-1 -t*(1.0 + x**2) - sym.sin(2+t**2)*y**2) },
     6: {'wetting': (-6.0 - (1.0 + t*t)*(1.0 + x*x)),
-        'nonwetting': (-1 -t*(1.0 + x**2) - sym.sqrt(2+t**2)*(1+y)*y**2) },
-    # 2: {'wetting': 1.0 - (1.0 + t*t)*(10.0 + x*x + (y-6.0)*(y-6.0)),
-    #     'nonwetting': - 2 - t*(1.0 + (y-6.0) + x**2)**2 -sym.sqrt(2+t**2)*(1.0 + (y-6.0))},
-    # 3: {'wetting': 1.0 - (1.0 + t*t)*(10.0 + x*x + (y-6.0)*(y-6.0)*3*sym.sin(-2*t+2*x)*sym.sin(1/2*y-1.2*t)),
-    #     'nonwetting': - 2 - t*(1.0 + x**2)**2 -sym.sqrt(2+t**2)},
-    # 4: {'wetting': 1.0 - (1.0 + t*t)*(10.0 + x*x + (y-6.0)*(y-6.0)*3*sym.sin(-2*t+2*x)*sym.sin(1/2*y-1.2*t)),
-    #     'nonwetting': - 2 - t*(1.0 + x**2)**2 -sym.sqrt(2+t**2)}
+        'nonwetting': (-1 -t*(1.0 + x**2) - sym.sin(2+t**2)*y**2) },
 }
 
 
diff --git a/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/TP-TP-layered_soil_with_inner_patch-realistic-different-model-change_mesh_study.py b/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/Archive/TP-TP-layered_soil_with_inner_patch-realistic-different-model-change_mesh_study.py
similarity index 100%
rename from Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/TP-TP-layered_soil_with_inner_patch-realistic-different-model-change_mesh_study.py
rename to Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/Archive/TP-TP-layered_soil_with_inner_patch-realistic-different-model-change_mesh_study.py
diff --git a/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/TP-TP-layered_soil_with_inner_patch-realistic-pure-dd_mesh_study.py b/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/Archive/TP-TP-layered_soil_with_inner_patch-realistic-pure-dd_mesh_study.py
similarity index 100%
rename from Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/TP-TP-layered_soil_with_inner_patch-realistic-pure-dd_mesh_study.py
rename to Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/Archive/TP-TP-layered_soil_with_inner_patch-realistic-pure-dd_mesh_study.py
diff --git a/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/TP-TP-layered_soil_with_inner_patch_mesh_study.py b/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/TP-TP-layered_soil_with_inner_patch_mesh_study.py
index 7220ca8..212c5f4 100755
--- a/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/TP-TP-layered_soil_with_inner_patch_mesh_study.py
+++ b/Two-phase-Two-phase/multi-patch/TP-TP-layered-soil-case-with-inner-patch/mesh_study/TP-TP-layered_soil_with_inner_patch_mesh_study.py
@@ -1,84 +1,147 @@
 #!/usr/bin/python3
-"""This program sets up a domain together with a decomposition into subdomains
-modelling layered soil. This is used for our LDD article with tp-tp and tp-r
-coupling.
+"""TP-TP layered soil with inner patch simulation.
 
-Along with the subdomains and the mesh domain markers are set upself.
-The resulting mesh is saved into files for later use.
+This program sets up an LDD simulation
 """
 
-#!/usr/bin/python3
 import dolfin as df
-import mshr
-import numpy as np
 import sympy as sym
-import typing as tp
 import functools as ft
-import domainPatch as dp
 import LDDsimulation as ldd
 import helpers as hlp
 import datetime
 import os
 import pandas as pd
 
+# init sympy session
+sym.init_printing()
+
+# PREREQUISITS  ###############################################################
+# check if output directory "./output" exists. This will be used in
+# the generation of the output string.
+if not os.path.exists('./output'):
+    os.mkdir('./output')
+    print("Directory ", './output',  " created ")
+else:
+    print("Directory ", './output',  " already exists. Will use as output \
+    directory")
+
 date = datetime.datetime.now()
 datestr = date.strftime("%Y-%m-%d")
 
-# init sympy session
-sym.init_printing()
-# solver_tol = 6E-7
-use_case = "TP-TP-layered-soil-pure-dd"
-max_iter_num = 200
+# Name of the usecase that will be printed during simulation.
+use_case = "TP-TP-layered-soil-inner-patch-realistic"
+# The name of this very file. Needed for creating log output.
+thisfile = "TP-TP-layered_soil_with_inner_patch_mesh_study.py"
+
+# GENERAL SOLVER CONFIG  ######################################################
+# maximal iteration per timestep
+max_iter_num = 1000
 FEM_Lagrange_degree = 1
+
+# GRID AND MESH STUDY SPECIFICATIONS  #########################################
 mesh_study = True
 resolutions = {
-                1: 5e-4,  # h=2
-                2: 5e-4,  # h=1.1180
-                4: 3e-4,  # h=0.5590
-                8: 1e-6,  # h=0.2814
-                16: 1e-6, # h=0.1412
-                32: 1e-6,   # h=0.0706
-                64: 1e-6,   # 0.03535
-                128: 1e-6,  # 0.01768
-                # 256: 1e-6  # 0.00884
+                # 1: 1e-6,
+                # 2: 1e-6,
+                # 4: 1e-6,
+                # 8: 1e-6,
+                16: 8e-6,
+                # 32: 8e-6,
+                # 64: 2e-6,
+                # 128: 1e-6,
+                # 256: 1e-6,
                 }
 
-############ GRID #######################
-# mesh_resolution = 20
-timestep_size = 0.005
-number_of_timesteps = 140
-plot_timestep_every = 1
-# decide how many timesteps you want analysed. Analysed means, that we write out
-# subsequent errors of the L-iteration within the timestep.
-number_of_timesteps_to_analyse = 6
-starttimes = [0.0]
+# starttimes gives a list of starttimes to run the simulation from.
+# The list is looped over and a simulation is run with t_0 as initial time
+#  for each element t_0 in starttimes.
+starttimes = [0.3]
+timestep_size = 0.001
+number_of_timesteps = 5
+
+# LDD scheme parameters  ######################################################
+Lw1 = 0.25  # /timestep_size
+Lnw1 = 0.25
+
+Lw2 = 0.25  # /timestep_size
+Lnw2 = 0.25
+
+Lw3 = 0.25 # /timestep_size
+Lnw3 = 0.25
+
+Lw4 = 0.25  # /timestep_size
+Lnw4 = 0.25
+
+Lw5 = 0.25  # /timestep_size
+Lnw5 = 0.25
+
+Lw6 = 0.25  # /timestep_size
+Lnw6 = 0.25
+
+lambda12_w = 4
+lambda12_nw = 4
+
+lambda23_w = 4
+lambda23_nw = 4
+
+lambda24_w = 4
+lambda24_nw= 4
+
+lambda25_w= 4
+lambda25_nw= 4
+
+lambda34_w = 4
+lambda34_nw = 4
 
-Lw = 0.025 #/timestep_size
-Lnw=Lw
+lambda36_w = 4
+lambda36_nw = 4
 
-lambda_w = 8
-lambda_nw = 8
+lambda45_w = 4
+lambda45_nw = 4
+
+lambda46_w = 4
+lambda46_nw = 4
+
+lambda56_w = 4
+lambda56_nw = 4
 
 include_gravity = False
-debugflag = False
-analyse_condition = True
+debugflag = True
+analyse_condition = False
 
-if mesh_study:
-    output_string = "./output/{}-{}_timesteps{}_P{}".format(datestr, use_case, number_of_timesteps, FEM_Lagrange_degree)
-else:
-    for tol in resolutions.values():
-        solver_tol = tol
-    output_string = "./output/{}-{}_timesteps{}_P{}_solver_tol{}".format(datestr, use_case, number_of_timesteps, FEM_Lagrange_degree, solver_tol)
+# I/O CONFIG  #################################################################
+# when number_of_timesteps is high, it might take a long time to write all
+# timesteps to disk. Therefore, you can choose to only write data of every
+# plot_timestep_every timestep to disk.
+plot_timestep_every = 1
+# Decide how many timesteps you want analysed. Analysed means, that
+# subsequent errors of the L-iteration within the timestep are written out.
+number_of_timesteps_to_analyse = 5
 
-# toggle what should be written to files
+# fine grained control over data to be written to disk in the mesh study case
+# as well as for a regular simuation for a fixed grid.
 if mesh_study:
     write_to_file = {
+        # output the relative errornorm (integration in space) w.r.t. an exact
+        # solution for each timestep into a csv file.
         'space_errornorms': True,
+        # save the mesh and marker functions to disk
         'meshes_and_markers': True,
+        # save xdmf/h5 data for each LDD iteration for timesteps determined by
+        # number_of_timesteps_to_analyse. I/O intensive!
         'L_iterations_per_timestep': False,
+        # save solution to xdmf/h5.
         'solutions': True,
+        # save absolute differences w.r.t an exact solution to xdmf/h5 file
+        # to monitor where on the domains errors happen
         'absolute_differences': True,
+        # analyise condition numbers for timesteps determined by
+        # number_of_timesteps_to_analyse and save them over time to csv.
         'condition_numbers': analyse_condition,
+        # output subsequent iteration errors measured in L^2  to csv for
+        # timesteps determined by number_of_timesteps_to_analyse.
+        # Usefull to monitor convergence of the acutal LDD solver.
         'subsequent_errors': True
     }
 else:
@@ -92,6 +155,13 @@ else:
         'subsequent_errors': True
     }
 
+# OUTPUT FILE STRING  #########################################################
+output_string = "./output/{}-{}_timesteps{}_P{}".format(
+    datestr, use_case, number_of_timesteps, FEM_Lagrange_degree
+    )
+
+
+# DOMAIN AND INTERFACES  #######################################################
 # global domain
 subdomain0_vertices = [df.Point(-1.0,-1.0), #
                         df.Point(1.0,-1.0),#
@@ -103,6 +173,80 @@ interface12_vertices = [df.Point(-1.0, 0.8),
                         df.Point(0.5, 0.9),
                         df.Point(0.8, 0.7),
                         df.Point(1.0, 0.65)]
+
+
+                        # interface23
+interface23_vertices = [df.Point(-1.0, 0.0),
+                        df.Point(-0.35, 0.0),
+                        # df.Point(6.5, 4.5),
+                        df.Point(0.0, 0.0)]
+
+interface24_vertices = [interface23_vertices[2],
+                        df.Point(0.6, 0.0),
+                        ]
+
+interface25_vertices = [interface24_vertices[1],
+                        df.Point(1.0, 0.0)
+                        ]
+
+
+interface32_vertices = [interface23_vertices[2],
+                        interface23_vertices[1],
+                        interface23_vertices[0]]
+
+
+interface36_vertices = [df.Point(-1.0, -0.6),
+                        df.Point(-0.6, -0.45)]
+
+
+interface46_vertices = [interface36_vertices[1],
+                        df.Point(0.3, -0.25)]
+
+interface56_vertices = [interface46_vertices[1],
+                        df.Point(0.65, -0.6),
+                        df.Point(1.0, -0.7)]
+
+
+
+
+interface34_vertices = [interface36_vertices[1],
+                        interface23_vertices[2]]
+
+# Interface 45 needs to be split, because of the shape. There can be triangles
+# with two facets on the interface and this creates a rogue dof type error when
+# integrating over that particular interface. Accordingly, the lambda_param
+# dictionary has two entries for that interface.
+interface45_vertices_a = [interface56_vertices[0],
+                        df.Point(0.7, -0.2),#df.Point(0.7, -0.2),
+                        ]
+interface45_vertices_b = [df.Point(0.7, -0.2),#df.Point(0.7, -0.2),
+                        interface25_vertices[0]
+                        ]
+
+# interface_vertices introduces a global numbering of interfaces.
+interface_def_points = [interface12_vertices,
+                        interface23_vertices,
+                        interface24_vertices,
+                        interface25_vertices,
+                        interface34_vertices,
+                        interface36_vertices,
+                        interface45_vertices_a,
+                        interface45_vertices_b,
+                        interface46_vertices,
+                        interface56_vertices,
+                        ]
+adjacent_subdomains = [[1,2],
+                       [2,3],
+                       [2,4],
+                       [2,5],
+                       [3,4],
+                       [3,6],
+                       [4,5],
+                       [4,5],
+                       [4,6],
+                       [5,6]
+                       ]
+
 # subdomain1.
 subdomain1_vertices = [interface12_vertices[0],
                         interface12_vertices[1],
@@ -117,32 +261,18 @@ subdomain1_vertices = [interface12_vertices[0],
 # the Dirichlet boundary conditions. If a domain is completely internal, the
 # dictionary entry should be 0: None
 subdomain1_outer_boundary_verts = {
-    0: [interface12_vertices[4], #
-        subdomain0_vertices[2], # eastern boundary, outer boundary
-        subdomain0_vertices[3],
-        interface12_vertices[0]]
+    0: [subdomain1_vertices[4], #
+        subdomain1_vertices[5], # eastern boundary, outer boundary
+        subdomain1_vertices[6],
+        subdomain1_vertices[0]]
 }
 
-
-# interface23
-interface23_vertices = [df.Point(-1.0, 0.0),
-                        df.Point(-0.35, 0.0),
-                        # df.Point(6.5, 4.5),
-                        df.Point(0.0, 0.0),
-                        df.Point(0.5, 0.0),
-                        # df.Point(11.5, 3.5),
-                        # df.Point(13.0, 3)
-                        df.Point(0.85, 0.0),
-                        df.Point(1.0, 0.0)
-                        ]
-
 #subdomain1
 subdomain2_vertices = [interface23_vertices[0],
                         interface23_vertices[1],
                         interface23_vertices[2],
-                        interface23_vertices[3],
-                        interface23_vertices[4],
-                        interface23_vertices[5], # southern boundary, 23 interface
+                        interface24_vertices[1],
+                        interface25_vertices[1], # southern boundary, 23 interface
                         subdomain1_vertices[4], # eastern boundary, outer boundary
                         subdomain1_vertices[3],
                         subdomain1_vertices[2],
@@ -150,54 +280,71 @@ subdomain2_vertices = [interface23_vertices[0],
                         subdomain1_vertices[0] ] # northern boundary, 12 interface
 
 subdomain2_outer_boundary_verts = {
-    0: [interface23_vertices[5],
-        subdomain1_vertices[4]],
-    1: [subdomain1_vertices[0],
-        interface23_vertices[0]]
+    0: [subdomain2_vertices[9],
+        subdomain2_vertices[0]],
+    1: [subdomain2_vertices[4],
+        subdomain2_vertices[5]]
 }
 
 
-# interface34
-interface34_vertices = [df.Point(-1.0, -0.6),
-                        df.Point(-0.6, -0.45),
-                        df.Point(0.3, -0.25),
-                        df.Point(0.65, -0.6),
-                        df.Point(1.0, -0.7)]
-
-# subdomain3
-subdomain3_vertices = [interface34_vertices[0],
-                        interface34_vertices[1],
-                        interface34_vertices[2],
-                        interface34_vertices[3],
-                        interface34_vertices[4], # southern boundary, 34 interface
-                        subdomain2_vertices[5], # eastern boundary, outer boundary
-                        subdomain2_vertices[4],
-                        subdomain2_vertices[3],
-                        subdomain2_vertices[2],
-                        subdomain2_vertices[1],
-                        subdomain2_vertices[0] ] # northern boundary, 23 interface
+subdomain3_vertices = [interface36_vertices[0],
+                       interface36_vertices[1],
+                       # interface34_vertices[0],
+                       interface34_vertices[1],
+                       # interface32_vertices[0],
+                       interface32_vertices[1],
+                       interface32_vertices[2]
+                       ]
 
 subdomain3_outer_boundary_verts = {
-    0: [interface34_vertices[4],
-        subdomain2_vertices[5]],
-    1: [subdomain2_vertices[0],
-        interface34_vertices[0]]
+    0: [subdomain3_vertices[4],
+        subdomain3_vertices[0]]
 }
 
-# subdomain4
-subdomain4_vertices = [subdomain0_vertices[0],
-                        subdomain0_vertices[1], # southern boundary, outer boundary
-                        subdomain3_vertices[4],# eastern boundary, outer boundary
-                        subdomain3_vertices[3],
-                        subdomain3_vertices[2],
-                        subdomain3_vertices[1],
-                        subdomain3_vertices[0] ] # northern boundary, 34 interface
-
-subdomain4_outer_boundary_verts = {
-    0: [subdomain4_vertices[6],
-        subdomain4_vertices[0],
-        subdomain4_vertices[1],
-        subdomain4_vertices[2]]
+
+# subdomain3
+subdomain4_vertices = [interface46_vertices[0],
+                       interface46_vertices[1],
+                       # interface45_vertices[1],
+                       interface45_vertices_a[1],
+                       interface24_vertices[1],
+                       interface24_vertices[0],
+                       interface34_vertices[1]
+                       ]
+
+subdomain4_outer_boundary_verts = None
+
+subdomain5_vertices = [interface56_vertices[0],
+                       interface56_vertices[1],
+                       interface56_vertices[2],
+                       interface25_vertices[1],
+                       interface25_vertices[0],
+                       interface45_vertices_b[1],
+                       interface45_vertices_b[0]
+]
+
+
+subdomain5_outer_boundary_verts = {
+    0: [subdomain5_vertices[2],
+        subdomain5_vertices[3]]
+}
+
+
+
+subdomain6_vertices = [subdomain0_vertices[0],
+                       subdomain0_vertices[1], # southern boundary, outer boundary
+                       interface56_vertices[2],
+                       interface56_vertices[1],
+                       interface56_vertices[0],
+                       interface36_vertices[1],
+                       interface36_vertices[0]
+                       ]
+
+subdomain6_outer_boundary_verts = {
+    0: [subdomain6_vertices[6],
+        subdomain6_vertices[0],
+        subdomain6_vertices[1],
+        subdomain6_vertices[2]]
 }
 
 
@@ -205,14 +352,12 @@ subdomain_def_points = [subdomain0_vertices,#
                       subdomain1_vertices,#
                       subdomain2_vertices,#
                       subdomain3_vertices,#
-                      subdomain4_vertices
+                      subdomain4_vertices,
+                      subdomain5_vertices,
+                      subdomain6_vertices
                       ]
 
 
-# interface_vertices introduces a global numbering of interfaces.
-interface_def_points = [interface12_vertices, interface23_vertices, interface34_vertices]
-adjacent_subdomains = [[1,2], [2,3], [3,4]]
-
 # if a subdomain has no outer boundary write None instead, i.e.
 # i: None
 # if i is the index of the inner subdomain.
@@ -221,158 +366,342 @@ outer_boundary_def_points = {
     1: subdomain1_outer_boundary_verts,
     2: subdomain2_outer_boundary_verts,
     3: subdomain3_outer_boundary_verts,
-    4: subdomain4_outer_boundary_verts
+    4: subdomain4_outer_boundary_verts,
+    5: subdomain5_outer_boundary_verts,
+    6: subdomain6_outer_boundary_verts
 }
 
+# MODEL CONFIGURATION #########################################################
+
 isRichards = {
     1: False,
     2: False,
     3: False,
-    4: False
+    4: False,
+    5: False,
+    6: False
     }
 
-# isRichards = {
-#     1: True,
-#     2: True,
-#     3: True,
-#     4: True
-#     }
 
 # Dict of the form: { subdom_num : viscosity }
 viscosity = {
-    1: {'wetting' :1,
-         'nonwetting': 1},
-    2: {'wetting' :1,
-         'nonwetting': 1},
-    3: {'wetting' :1,
-         'nonwetting': 1},
-    4: {'wetting' :1,
-         'nonwetting': 1},
+    1: {'wetting' :1.0,
+         'nonwetting': 1/50},
+    2: {'wetting' :1.0,
+         'nonwetting': 1/50},
+    3: {'wetting' :1.0,
+         'nonwetting': 1/50},
+    4: {'wetting' :1.0,
+         'nonwetting': 1/50},
+    5: {'wetting' :1.0,
+         'nonwetting': 1/50},
+    6: {'wetting' :1.0,
+         'nonwetting': 1/50},
 }
 
 # Dict of the form: { subdom_num : density }
 densities = {
-    1: {'wetting': 1,  #997
-         'nonwetting':1},  #1.225}},
-    2: {'wetting': 1,  #997
-         'nonwetting':1},  #1.225}},
-    3: {'wetting': 1,  #997
-         'nonwetting':1},  #1.225}},
-    4: {'wetting': 1,  #997
-         'nonwetting':1},  #1.225}}
+    1: {'wetting': 997.0,  #997
+         'nonwetting': 1.225},  #1},  #1.225},
+    2: {'wetting': 997.0,  #997
+         'nonwetting': 1.225},  #1.225},
+    3: {'wetting': 997.0,  #997
+         'nonwetting': 1.225},  #1.225},
+    4: {'wetting': 997.0,  #997
+         'nonwetting': 1.225},  #1.225}
+    5: {'wetting': 997.0,  #997
+         'nonwetting': 1.225},  #1.225},
+    6: {'wetting': 997.0,  #997
+         'nonwetting': 1.225}  #1.225}
 }
 
-gravity_acceleration = 1
+gravity_acceleration = 9.81
 # porosities taken from
 # https://www.geotechdata.info/parameter/soil-porosity.html
 # Dict of the form: { subdom_num : porosity }
 porosity = {
-    1: 1,  #0.2,  # Clayey gravels, clayey sandy gravels
-    2: 1,  #0.22, # Silty gravels, silty sandy gravels
-    3: 1,  #0.37, # Clayey sands
-    4: 1,  #0.2 # Silty or sandy clay
+    1: 0.2,  #0.2,  # Clayey gravels, clayey sandy gravels
+    2: 0.2,  #0.22, # Silty gravels, silty sandy gravels
+    3: 0.2,  #0.37, # Clayey sands
+    4: 0.2,  #0.2 # Silty or sandy clay
+    5: 0.2,  #
+    6: 0.2,  #
 }
 
 # subdom_num : subdomain L for L-scheme
 L = {
-    1: {'wetting' :Lw,
-         'nonwetting': Lnw},
-    2: {'wetting' :Lw,
-         'nonwetting': Lnw},
-    3: {'wetting' :Lw,
-         'nonwetting': Lnw},
-    4: {'wetting' :Lw,
-         'nonwetting': Lnw}
+    1: {'wetting' :Lw1,
+         'nonwetting': Lnw1},
+    2: {'wetting' :Lw2,
+         'nonwetting': Lnw2},
+    3: {'wetting' :Lw3,
+         'nonwetting': Lnw3},
+    4: {'wetting' :Lw4,
+         'nonwetting': Lnw4},
+    5: {'wetting' :Lw5,
+         'nonwetting': Lnw5},
+    6: {'wetting' :Lw6,
+         'nonwetting': Lnw6}
 }
 
-# subdom_num : lambda parameter for the L-scheme
+
+# interface_num : lambda parameter for the L-scheme on that interface.
+# Note that interfaces are numbered starting from 0, because
+# adjacent_subdomains is a list and not a dict. Historic fuckup, I know
+# We have defined above as interfaces
+# # interface_vertices introduces a global numbering of interfaces.
+# interface_def_points = [interface12_vertices,
+#                         interface23_vertices,
+#                         interface24_vertices,
+#                         interface25_vertices,
+#                         interface34_vertices,
+#                         interface36_vertices,
+#                         interface45_vertices_a,
+#                         interface45_vertices_b,
+#                         interface46_vertices,
+#                         interface56_vertices,
+#                         ]
 lambda_param = {
-    1: {'wetting': lambda_w,
-         'nonwetting': lambda_nw},#
-    2: {'wetting': lambda_w,
-         'nonwetting': lambda_nw},#
-    3: {'wetting': lambda_w,
-         'nonwetting': lambda_nw},#
-    4: {'wetting': lambda_w,
-         'nonwetting': lambda_nw},#
+    0: {'wetting': lambda12_w,
+         'nonwetting': lambda12_nw},
+    1: {'wetting': lambda23_w,
+         'nonwetting': lambda23_nw},
+    2: {'wetting': lambda24_w,
+         'nonwetting': lambda24_nw},
+    3: {'wetting': lambda25_w,
+         'nonwetting': lambda25_nw},
+    4: {'wetting': lambda34_w,
+         'nonwetting': lambda34_nw},
+    5: {'wetting': lambda36_w,
+         'nonwetting': lambda36_nw},
+    6: {'wetting': lambda45_w,
+         'nonwetting': lambda45_nw},
+    7: {'wetting': lambda45_w,
+         'nonwetting': lambda45_nw},
+    8: {'wetting': lambda46_w,
+         'nonwetting': lambda46_nw},
+    9: {'wetting': lambda56_w,
+         'nonwetting': lambda56_nw},
+}
+
+# after Lewis, see pdf file
+intrinsic_permeability = {
+    1: 0.01,  # sand
+    2: 0.01,  # sand, there is a range
+    3: 0.01,  #10e-2,  # clay has a range
+    4: 0.01,  #10e-3
+    5: 0.01,  #10e-2,  # clay has a range
+    6: 0.01,  #10e-3
 }
 
 
-## relative permeabilty functions on subdomain 1
+# relative permeabilty functions on subdomain 1
 def rel_perm1w(s):
     # relative permeabilty wetting on subdomain1
-    return s**2
+    return intrinsic_permeability[1]*s**2
 
 
 def rel_perm1nw(s):
     # relative permeabilty nonwetting on subdomain1
-    return (1-s)**2
+    return intrinsic_permeability[1]*(1-s)**2
 
 
-## relative permeabilty functions on subdomain 2
+# relative permeabilty functions on subdomain 2
 def rel_perm2w(s):
     # relative permeabilty wetting on subdomain2
-    return s**2
+    return intrinsic_permeability[2]*s**2
 
 
 def rel_perm2nw(s):
-    # relative permeabilty nonwetting on subdosym.cos(0.8*t - (0.8*x + 1/7*y))main2
-    return (1-s)**2
+    # relative permeabilty nonwetting on subdomain2
+    return intrinsic_permeability[2]*(1-s)**2
+
+
+# relative permeabilty functions on subdomain 3
+def rel_perm3w(s):
+    # relative permeabilty wetting on subdomain3
+    return intrinsic_permeability[3]*s**3
+
+
+def rel_perm3nw(s):
+    # relative permeabilty nonwetting on subdomain3
+    return intrinsic_permeability[3]*(1-s)**3
+
+
+# relative permeabilty functions on subdomain 4
+def rel_perm4w(s):
+    # relative permeabilty wetting on subdomain4
+    return intrinsic_permeability[4]*s**3
+
+
+def rel_perm4nw(s):
+    # relative permeabilty nonwetting on subdomain4
+    return intrinsic_permeability[4]*(1-s)**3
+
+
+# relative permeabilty functions on subdomain 5
+def rel_perm5w(s):
+    # relative permeabilty wetting on subdomain5
+    return intrinsic_permeability[5]*s**3
+
+
+def rel_perm5nw(s):
+    # relative permeabilty nonwetting on subdomain5
+    return intrinsic_permeability[5]*(1-s)**3
+
+
+# relative permeabilty functions on subdomain 6
+def rel_perm6w(s):
+    # relative permeabilty wetting on subdomain6
+    return intrinsic_permeability[6]*s**3
+
+
+def rel_perm6nw(s):
+    # relative permeabilty nonwetting on subdomain6
+    return intrinsic_permeability[6]*(1-s)**3
 
 
 _rel_perm1w = ft.partial(rel_perm1w)
 _rel_perm1nw = ft.partial(rel_perm1nw)
+
 _rel_perm2w = ft.partial(rel_perm2w)
 _rel_perm2nw = ft.partial(rel_perm2nw)
 
+_rel_perm3w = ft.partial(rel_perm3w)
+_rel_perm3nw = ft.partial(rel_perm3nw)
+
+_rel_perm4w = ft.partial(rel_perm4w)
+_rel_perm4nw = ft.partial(rel_perm4nw)
+
+_rel_perm5w = ft.partial(rel_perm5w)
+_rel_perm5nw = ft.partial(rel_perm5nw)
+
+_rel_perm6w = ft.partial(rel_perm6w)
+_rel_perm6nw = ft.partial(rel_perm6nw)
+
 subdomain1_rel_perm = {
-    'wetting': _rel_perm1w,#
+    'wetting': _rel_perm1w,
     'nonwetting': _rel_perm1nw
 }
 
 subdomain2_rel_perm = {
-    'wetting': _rel_perm2w,#
+    'wetting': _rel_perm2w,
     'nonwetting': _rel_perm2nw
 }
 
-# _rel_perm3 = ft.partial(rel_perm2)
-# subdomain3_rel_perm = subdomain2_rel_perm.copy()
-#
-# _rel_perm4 = ft.partial(rel_perm1)
-# subdomain4_rel_perm = subdomain1_rel_perm.copy()
+subdomain3_rel_perm = {
+    'wetting': _rel_perm3w,
+    'nonwetting': _rel_perm3nw
+}
+
+subdomain4_rel_perm = {
+    'wetting': _rel_perm4w,
+    'nonwetting': _rel_perm4nw
+}
+
+subdomain5_rel_perm = {
+    'wetting': _rel_perm5w,
+    'nonwetting': _rel_perm5nw
+}
+
+subdomain6_rel_perm = {
+    'wetting': _rel_perm6w,
+    'nonwetting': _rel_perm6nw
+}
 
 # dictionary of relative permeabilties on all domains.
 relative_permeability = {
     1: subdomain1_rel_perm,
-    2: subdomain1_rel_perm,
-    3: subdomain2_rel_perm,
-    4: subdomain2_rel_perm
+    2: subdomain2_rel_perm,
+    3: subdomain3_rel_perm,
+    4: subdomain4_rel_perm,
+    5: subdomain5_rel_perm,
+    6: subdomain6_rel_perm
 }
 
+
 # definition of the derivatives of the relative permeabilities
 # relative permeabilty functions on subdomain 1
 def rel_perm1w_prime(s):
     # relative permeabilty on subdomain1
-    return 2*s
+    return intrinsic_permeability[1]*2*s
+
 
 def rel_perm1nw_prime(s):
     # relative permeabilty on subdomain1
-    return -2*(1-s)
+    return -1*intrinsic_permeability[1]*2*(1-s)
+
 
-# definition of the derivatives of the relative permeabilities
-# relative permeabilty functions on subdomain 1
 def rel_perm2w_prime(s):
-    # relative permeabilty on subdomain1
-    return 2*s
+    # relative permeabilty on subdomain2
+    return intrinsic_permeability[2]*2*s
+
 
 def rel_perm2nw_prime(s):
-    # relative permeabilty on subdomain1
-    return -2*(1-s)
+    # relative permeabilty on subdomain2
+    return -1*intrinsic_permeability[2]*2*(1-s)
+
+
+# definition of the derivatives of the relative permeabilities
+# relative permeabilty functions on subdomain 3
+def rel_perm3w_prime(s):
+    # relative permeabilty on subdomain3
+    return intrinsic_permeability[3]*3*s**2
+
+
+def rel_perm3nw_prime(s):
+    # relative permeabilty on subdomain3
+    return -1*intrinsic_permeability[3]*3*(1-s)**2
+
+
+# definition of the derivatives of the relative permeabilities
+# relative permeabilty functions on subdomain 4
+def rel_perm4w_prime(s):
+    # relative permeabilty on subdomain4
+    return intrinsic_permeability[4]*3*s**2
+
+
+def rel_perm4nw_prime(s):
+    # relative permeabilty on subdomain4
+    return -1*intrinsic_permeability[4]*3*(1-s)**2
+
+
+# definition of the derivatives of the relative permeabilities
+# relative permeabilty functions on subdomain 5
+def rel_perm5w_prime(s):
+    # relative permeabilty on subdomain5
+    return intrinsic_permeability[5]*3*s**2
+
+
+def rel_perm5nw_prime(s):
+    # relative permeabilty on subdomain5
+    return -1*intrinsic_permeability[5]*3*(1-s)**2
+
+
+# definition of the derivatives of the relative permeabilities
+# relative permeabilty functions on subdomain 6
+def rel_perm6w_prime(s):
+    # relative permeabilty on subdomain6
+    return intrinsic_permeability[6]*3*s**2
+
+
+def rel_perm6nw_prime(s):
+    # relative permeabilty on subdomain6
+    return -1*intrinsic_permeability[6]*3*(1-s)**2
+
 
 _rel_perm1w_prime = ft.partial(rel_perm1w_prime)
 _rel_perm1nw_prime = ft.partial(rel_perm1nw_prime)
 _rel_perm2w_prime = ft.partial(rel_perm2w_prime)
 _rel_perm2nw_prime = ft.partial(rel_perm2nw_prime)
+_rel_perm3w_prime = ft.partial(rel_perm3w_prime)
+_rel_perm3nw_prime = ft.partial(rel_perm3nw_prime)
+_rel_perm4w_prime = ft.partial(rel_perm4w_prime)
+_rel_perm4nw_prime = ft.partial(rel_perm4nw_prime)
+_rel_perm5w_prime = ft.partial(rel_perm5w_prime)
+_rel_perm5nw_prime = ft.partial(rel_perm5nw_prime)
+_rel_perm6w_prime = ft.partial(rel_perm6w_prime)
+_rel_perm6nw_prime = ft.partial(rel_perm6nw_prime)
 
 subdomain1_rel_perm_prime = {
     'wetting': _rel_perm1w_prime,
@@ -385,110 +714,170 @@ subdomain2_rel_perm_prime = {
     'nonwetting': _rel_perm2nw_prime
 }
 
+subdomain3_rel_perm_prime = {
+    'wetting': _rel_perm3w_prime,
+    'nonwetting': _rel_perm3nw_prime
+}
+
+
+subdomain4_rel_perm_prime = {
+    'wetting': _rel_perm4w_prime,
+    'nonwetting': _rel_perm4nw_prime
+}
+
+subdomain5_rel_perm_prime = {
+    'wetting': _rel_perm5w_prime,
+    'nonwetting': _rel_perm5nw_prime
+}
+
+subdomain6_rel_perm_prime = {
+    'wetting': _rel_perm6w_prime,
+    'nonwetting': _rel_perm6nw_prime
+}
+
+
 # dictionary of relative permeabilties on all domains.
 ka_prime = {
     1: subdomain1_rel_perm_prime,
-    2: subdomain1_rel_perm_prime,
-    3: subdomain2_rel_perm_prime,
-    4: subdomain2_rel_perm_prime
+    2: subdomain2_rel_perm_prime,
+    3: subdomain3_rel_perm_prime,
+    4: subdomain4_rel_perm_prime,
+    5: subdomain5_rel_perm_prime,
+    6: subdomain6_rel_perm_prime,
 }
 
 
 
-# S-pc-relation ship. We use the van Genuchten approach, i.e. pc = 1/alpha*(S^{-1/m} -1)^1/n, where
-# we set alpha = 0, assume m = 1-1/n (see Helmig) and assume that residual saturation is Sw
-# this function needs to be monotonically decreasing in the capillary pressure pc.
-# since in the richards case pc=-pw, this becomes as a function of pw a mono
+# S-pc-relation ship. We use the van Genuchten approach, i.e.
+# pc = 1/alpha*(S^{-1/m} -1)^1/n, where we set alpha = 0, assume
+# m = 1-1/n (see Helmig) and assume that residual saturation is Sw
+# this function needs to be monotonically decreasing in the capillary pressure
+# pc.
+# Since in the richards case pc=-pw, this becomes as a function of pw a mono
 # tonically INCREASING function like in our Richards-Richards paper. However
 # since we unify the treatment in the code for Richards and two-phase, we need
 # the same requierment
 # for both cases, two-phase and Richards.
-def saturation(pc, n_index, alpha):
+# def saturation(pc, n_index, alpha):
+#     # inverse capillary pressure-saturation-relationship
+#     return df.conditional(pc > 0, 1/((1 + (alpha*pc)**n_index)**((n_index - 1)/n_index)), 1)
+#
+# # S-pc-relation ship. We use the van Genuchten approach, i.e. pc = 1/alpha*(S^{-1/m} -1)^1/n, where
+# # we set alpha = 0, assume m = 1-1/n (see Helmig) and assume that residual saturation is Sw
+# def saturation_sym(pc, n_index, alpha):
+#     # inverse capillary pressure-saturation-relationship
+#     #df.conditional(pc > 0,
+#     return 1/((1 + (alpha*pc)**n_index)**((n_index - 1)/n_index))
+#
+#
+# # derivative of S-pc relationship with respect to pc. This is needed for the
+# # construction of a analytic solution.
+# def saturation_sym_prime(pc, n_index, alpha):
+#     # inverse capillary pressure-saturation-relationship
+#     return -(alpha*(n_index - 1)*(alpha*pc)**(n_index - 1)) / ( (1 + (alpha*pc)**n_index)**((2*n_index - 1)/n_index) )
+##
+# # note that the conditional definition of S-pc in the nonsymbolic part will be
+# # incorporated in the construction of the exact solution below.
+# S_pc_sym = {
+#     1: ft.partial(saturation_sym, n_index=3, alpha=0.001),
+#     2: ft.partial(saturation_sym, n_index=3, alpha=0.001),
+#     3: ft.partial(saturation_sym, n_index=3, alpha=0.001),
+#     4: ft.partial(saturation_sym, n_index=3, alpha=0.001),
+#     5: ft.partial(saturation_sym, n_index=3, alpha=0.001),
+#     6: ft.partial(saturation_sym, n_index=3, alpha=0.001)
+# }
+#
+# S_pc_sym_prime = {
+#     1: ft.partial(saturation_sym_prime, n_index=3, alpha=0.001),
+#     2: ft.partial(saturation_sym_prime, n_index=3, alpha=0.001),
+#     3: ft.partial(saturation_sym_prime, n_index=3, alpha=0.001),
+#     4: ft.partial(saturation_sym_prime, n_index=3, alpha=0.001),
+#     5: ft.partial(saturation_sym_prime, n_index=3, alpha=0.001),
+#     6: ft.partial(saturation_sym_prime, n_index=3, alpha=0.001)
+# }
+#
+# sat_pressure_relationship = {
+#     1: ft.partial(saturation, n_index=3, alpha=0.001),
+#     2: ft.partial(saturation, n_index=3, alpha=0.001),
+#     3: ft.partial(saturation, n_index=3, alpha=0.001),
+#     4: ft.partial(saturation, n_index=3, alpha=0.001),
+#     5: ft.partial(saturation, n_index=3, alpha=0.001),
+#     6: ft.partial(saturation, n_index=3, alpha=0.001)
+# }
+
+def saturation(pc, n_index):
     # inverse capillary pressure-saturation-relationship
-    return df.conditional(pc > 0, 1/((1 + (alpha*pc)**n_index)**((n_index - 1)/n_index)), 1)
+    return df.conditional(pc > 0, 1/((1 + pc)**(1/(n_index + 1))), 1)
+
 
-# S-pc-relation ship. We use the van Genuchten approach, i.e. pc = 1/alpha*(S^{-1/m} -1)^1/n, where
-# we set alpha = 0, assume m = 1-1/n (see Helmig) and assume that residual saturation is Sw
-def saturation_sym(pc, n_index, alpha):
+def saturation_sym(pc, n_index):
     # inverse capillary pressure-saturation-relationship
-    #df.conditional(pc > 0,
-    return 1/((1 + (alpha*pc)**n_index)**((n_index - 1)/n_index))
+    return 1/((1 + pc)**(1/(n_index + 1)))
 
 
-# derivative of S-pc relationship with respect to pc. This is needed for the
-# construction of a analytic solution.
-def saturation_sym_prime(pc, n_index, alpha):
+def saturation_sym_prime(pc, n_index):
     # inverse capillary pressure-saturation-relationship
-    return -(alpha*(n_index - 1)*(alpha*pc)**(n_index - 1)) / ( (1 + (alpha*pc)**n_index)**((2*n_index - 1)/n_index) )
+    return -1/((n_index+1)*(1 + pc)**((n_index+2)/(n_index+1)))
 
 
-# note that the conditional definition of S-pc in the nonsymbolic part will be
-# incorporated in the construction of the exact solution below.
 S_pc_sym = {
-    1: ft.partial(saturation_sym, n_index=3, alpha=0.001),
-    2: ft.partial(saturation_sym, n_index=3, alpha=0.001),
-    3: ft.partial(saturation_sym, n_index=3, alpha=0.001),
-    4: ft.partial(saturation_sym, n_index=3, alpha=0.001)
+    1: ft.partial(saturation_sym, n_index=1),
+    2: ft.partial(saturation_sym, n_index=1),
+    3: ft.partial(saturation_sym, n_index=2),
+    4: ft.partial(saturation_sym, n_index=2),
+    5: ft.partial(saturation_sym, n_index=2),
+    6: ft.partial(saturation_sym, n_index=2)
 }
 
 S_pc_sym_prime = {
-    1: ft.partial(saturation_sym_prime, n_index=3, alpha=0.001),
-    2: ft.partial(saturation_sym_prime, n_index=3, alpha=0.001),
-    3: ft.partial(saturation_sym_prime, n_index=3, alpha=0.001),
-    4: ft.partial(saturation_sym_prime, n_index=3, alpha=0.001)
+    1: ft.partial(saturation_sym_prime, n_index=1),
+    2: ft.partial(saturation_sym_prime, n_index=1),
+    3: ft.partial(saturation_sym_prime, n_index=2),
+    4: ft.partial(saturation_sym_prime, n_index=2),
+    5: ft.partial(saturation_sym_prime, n_index=2),
+    6: ft.partial(saturation_sym_prime, n_index=2)
 }
 
 sat_pressure_relationship = {
-    1: ft.partial(saturation, n_index=3, alpha=0.001),
-    2: ft.partial(saturation, n_index=3, alpha=0.001),
-    3: ft.partial(saturation, n_index=3, alpha=0.001),
-    4: ft.partial(saturation, n_index=3, alpha=0.001)
+    1: ft.partial(saturation, n_index=1),
+    2: ft.partial(saturation, n_index=1),
+    3: ft.partial(saturation, n_index=2),
+    4: ft.partial(saturation, n_index=2),
+    5: ft.partial(saturation, n_index=2),
+    6: ft.partial(saturation, n_index=2)
 }
 
 
-#############################################
+###############################################################################
 # Manufacture source expressions with sympy #
-#############################################
+###############################################################################
 x, y = sym.symbols('x[0], x[1]')  # needed by UFL
 t = sym.symbols('t', positive=True)
 
-p_e_sym_2patch = {
-    1: {'wetting': -7 - (1+t*t)*(1 + x*x + y*y),
-        'nonwetting': -1-t*(1.1 + y + x**2)},
-    2: {'wetting': -7.0 - (1.0 + t*t)*(1.0 + x*x + y*y),
-        'nonwetting': -1-t*(1.1 + y + x**2)},
-}
 
 p_e_sym = {
-    1: {'wetting': p_e_sym_2patch[1]['wetting'],
-        'nonwetting': p_e_sym_2patch[1]['nonwetting']},
-    2: {'wetting': p_e_sym_2patch[1]['wetting'],
-        'nonwetting': p_e_sym_2patch[1]['nonwetting']},
-    3: {'wetting': p_e_sym_2patch[2]['wetting'],
-        'nonwetting': p_e_sym_2patch[2]['nonwetting']},
-    4: {'wetting': p_e_sym_2patch[2]['wetting'],
-        'nonwetting': p_e_sym_2patch[2]['nonwetting']}
+        1: {'wetting': -6.0 - (1.0 + t*t)*(1.0 + x*x + y*y),
+        'nonwetting': (-1 -t*(1.1 + y + x**2)) },
+    2: {'wetting': -6.0 - (1.0 + t*t)*(1.0 + x*x + y*y),
+        'nonwetting': (-1 -t*(1.1 + y + x**2)) },
+    3: {'wetting': (-6.0 - (1.0 + t*t)*(1.0 + x*x)),
+        'nonwetting': (-1 -t*(1.0 + x**2) - sym.sin(2+t**2)*y**2) },
+    4: {'wetting': (-6.0 - (1.0 + t*t)*(1.0 + x*x)),
+        'nonwetting': (-1 -t*(1.0 + x**2) - sym.sin(2+t**2)*y**2) },
+    5: {'wetting': (-6.0 - (1.0 + t*t)*(1.0 + x*x)),
+        'nonwetting': (-1 -t*(1.0 + x**2) - sym.sin(2+t**2)*y**2) },
+    6: {'wetting': (-6.0 - (1.0 + t*t)*(1.0 + x*x)),
+        'nonwetting': (-1 -t*(1.0 + x**2) - sym.sin(2+t**2)*y**2) },
 }
 
 
-# p_e_sym = {
-#     1: {'wetting': 1.0 - (1.0 + t*t)*(10.0 + x*x + (y-5.0)*(y-5.0)),
-#         'nonwetting': - 2 - t*(1 + (y-5.0) + x**2)**2 -sym.sqrt(2+t**2)*(1 + (y-5.0)) },
-#     2: {'wetting': 1.0 - (1.0 + t*t)*(10.0 + x*x + (y-5.0)*(y-5.0)),
-#         'nonwetting': - 2 - t*(1 + (y-5.0) + x**2)**2 -sym.sqrt(2+t**2)*(1 + (y-5.0))},
-#     3: {'wetting': 1.0 - (1.0 + t*t)*(10.0 + x*x + (y-5.0)*(y-5.0)) - (y-5.0)*(y-5.0)*3*sym.sin(-2*t+2*x)*sym.sin(1/2*y-1.2*t),
-#         'nonwetting': - 2 - t*(1 + x**2)**2 -sym.sqrt(2+t**2)},
-#     4: {'wetting': 1.0 - (1.0 + t*t)*(10.0 + x*x + (y-5.0)*(y-5.0)) - (y-5.0)*(y-5.0)*3*sym.sin(-2*t+2*x)*sym.sin(1/2*y-1.2*t),
-#         'nonwetting': - 2 - t*(1 + x**2)**2 -sym.sqrt(2+t**2)}
-# }
-
 pc_e_sym = dict()
 for subdomain, isR in isRichards.items():
     if isR:
-        pc_e_sym.update({subdomain: -p_e_sym[subdomain]['wetting']})
+        pc_e_sym.update({subdomain: -p_e_sym[subdomain]['wetting'].copy()})
     else:
-        pc_e_sym.update({subdomain: p_e_sym[subdomain]['nonwetting']
-                                        - p_e_sym[subdomain]['wetting']})
+        pc_e_sym.update({subdomain: p_e_sym[subdomain]['nonwetting'].copy()
+                                        - p_e_sym[subdomain]['wetting'].copy()})
 
 
 symbols = {"x": x,
@@ -515,6 +904,7 @@ source_expression = exact_solution_example['source']
 exact_solution = exact_solution_example['exact_solution']
 initial_condition = exact_solution_example['initial_condition']
 
+# BOUNDARY CONDITIONS #########################################################
 # Dictionary of dirichlet boundary conditions.
 dirichletBC = dict()
 # similarly to the outer boundary dictionary, if a patch has no outer boundary
@@ -531,7 +921,7 @@ dirichletBC = dict()
 
 # subdomain index: {outer boudary part index: {phase: expression}}
 for subdomain in isRichards.keys():
-    # if subdomain has no outer boundary, outer_boundary_def_points[subdomain] is None
+    # subdomain can have no outer boundary
     if outer_boundary_def_points[subdomain] is None:
         dirichletBC.update({subdomain: None})
     else:
@@ -543,6 +933,16 @@ for subdomain in isRichards.keys():
                 {outer_boundary_ind: exact_solution[subdomain]}
                 )
 
+
+# LOG FILE OUTPUT #############################################################
+# read this file and print it to std out. This way the simulation can produce a
+# log file with ./TP-R-layered_soil.py | tee simulation.log
+f = open(thisfile, 'r')
+print(f.read())
+f.close()
+
+
+# RUN #########################################################################
 for starttime in starttimes:
     for mesh_resolution, solver_tol in resolutions.items():
         # initialise LDD simulation class
@@ -555,33 +955,35 @@ for starttime in starttimes:
             mesh_study=mesh_study
             )
 
-        simulation.set_parameters(use_case=use_case,
-                                  output_dir=output_string,
-                                  subdomain_def_points=subdomain_def_points,
-                                  isRichards=isRichards,
-                                  interface_def_points=interface_def_points,
-                                  outer_boundary_def_points=outer_boundary_def_points,
-                                  adjacent_subdomains=adjacent_subdomains,
-                                  mesh_resolution=mesh_resolution,
-                                  viscosity=viscosity,
-                                  porosity=porosity,
-                                  L=L,
-                                  lambda_param=lambda_param,
-                                  relative_permeability=relative_permeability,
-                                  saturation=sat_pressure_relationship,
-                                  starttime=starttime,
-                                  number_of_timesteps=number_of_timesteps,
-                                  number_of_timesteps_to_analyse=number_of_timesteps_to_analyse,
-                                  plot_timestep_every=plot_timestep_every,
-                                  timestep_size=timestep_size,
-                                  sources=source_expression,
-                                  initial_conditions=initial_condition,
-                                  dirichletBC_expression_strings=dirichletBC,
-                                  exact_solution=exact_solution,
-                                  densities=densities,
-                                  include_gravity=include_gravity,
-                                  write2file=write_to_file,
-                                  )
+        simulation.set_parameters(
+            use_case=use_case,
+            output_dir=output_string,
+            subdomain_def_points=subdomain_def_points,
+            isRichards=isRichards,
+            interface_def_points=interface_def_points,
+            outer_boundary_def_points=outer_boundary_def_points,
+            adjacent_subdomains=adjacent_subdomains,
+            mesh_resolution=mesh_resolution,
+            viscosity=viscosity,
+            porosity=porosity,
+            L=L,
+            lambda_param=lambda_param,
+            relative_permeability=relative_permeability,
+            saturation=sat_pressure_relationship,
+            starttime=starttime,
+            number_of_timesteps=number_of_timesteps,
+            number_of_timesteps_to_analyse=number_of_timesteps_to_analyse,
+            plot_timestep_every=plot_timestep_every,
+            timestep_size=timestep_size,
+            sources=source_expression,
+            initial_conditions=initial_condition,
+            dirichletBC_expression_strings=dirichletBC,
+            exact_solution=exact_solution,
+            densities=densities,
+            include_gravity=include_gravity,
+            gravity_acceleration=gravity_acceleration,
+            write2file=write_to_file,
+            )
 
         simulation.initialise()
         output_dir = simulation.output_dir
@@ -589,26 +991,39 @@ for starttime in starttimes:
         output = simulation.run(analyse_condition=analyse_condition)
         for subdomain_index, subdomain_output in output.items():
             mesh_h = subdomain_output['mesh_size']
-            for phase, different_errornorms in subdomain_output['errornorm'].items():
-                filename = output_dir + "subdomain{}-space-time-errornorm-{}-phase.csv".format(subdomain_index, phase)
-                # for errortype, errornorm in different_errornorms.items():
-
-                    # eocfile = open("eoc_filename", "a")
-                    # eocfile.write( str(mesh_h) + " " + str(errornorm) + "\n" )
-                    # eocfile.close()
-                    # if subdomain.isRichards:mesh_h
+            for phase, error_dict in subdomain_output['errornorm'].items():
+                filename = output_dir \
+                    + "subdomain{}".format(subdomain_index)\
+                    + "-space-time-errornorm-{}-phase.csv".format(phase)
+                # for errortype, errornorm in error_dict.items():
+
+                # eocfile = open("eoc_filename", "a")
+                # eocfile.write( str(mesh_h) + " " + str(errornorm) + "\n" )
+                # eocfile.close()
+                # if subdomain.isRichards:mesh_h
                 data_dict = {
                     'mesh_parameter': mesh_resolution,
                     'mesh_h': mesh_h,
                 }
-                for error_type, errornorms in different_errornorms.items():
+                for norm_type, errornorm in error_dict.items():
                     data_dict.update(
-                        {error_type: errornorms}
+                        {norm_type: errornorm}
                     )
                 errors = pd.DataFrame(data_dict, index=[mesh_resolution])
                 # check if file exists
-                if os.path.isfile(filename) == True:
+                if os.path.isfile(filename) is True:
                     with open(filename, 'a') as f:
-                        errors.to_csv(f, header=False, sep='\t', encoding='utf-8', index=False)
+                        errors.to_csv(
+                            f,
+                            header=False,
+                            sep='\t',
+                            encoding='utf-8',
+                            index=False
+                            )
                 else:
-                    errors.to_csv(filename, sep='\t', encoding='utf-8', index=False)
+                    errors.to_csv(
+                        filename,
+                        sep='\t',
+                        encoding='utf-8',
+                        index=False
+                        )
-- 
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