diff --git a/.github/workflows/build_and_test.yaml b/.github/workflows/build_and_test.yaml
index f4be766..a1042b2 100644
--- a/.github/workflows/build_and_test.yaml
+++ b/.github/workflows/build_and_test.yaml
@@ -33,7 +33,7 @@ jobs:
uses: actions/checkout@v4
- name: Set up pixi
- uses: prefix-dev/setup-pixi@v0.8.8
+ uses: prefix-dev/setup-pixi@v0.8.10
- name: Generate build directory
run: mkdir -p ${{ env.FANS_BUILD_DIR }}
diff --git a/.github/workflows/build_and_test_mac.yaml b/.github/workflows/build_and_test_mac.yaml
index b917d18..c6d9107 100644
--- a/.github/workflows/build_and_test_mac.yaml
+++ b/.github/workflows/build_and_test_mac.yaml
@@ -33,7 +33,7 @@ jobs:
brew install fftw eigen
- name: Set up pixi
- uses: prefix-dev/setup-pixi@v0.8.8
+ uses: prefix-dev/setup-pixi@v0.8.10
- name: Generate build directory
run: mkdir -p ${{ env.FANS_BUILD_DIR }}
diff --git a/CHANGELOG.md b/CHANGELOG.md
index 5f62666..9e00faa 100644
--- a/CHANGELOG.md
+++ b/CHANGELOG.md
@@ -1,5 +1,11 @@
# FANS Changelog
+## v0.4.2
+
+- Reduce dependencies of dashboard for cf-package https://github.com/DataAnalyticsEngineering/FANS/pull/71
+- Add pixi task `h52xdmf` to generate XDMF from H5 files directly as `pixi run h52xdmf {h5filepath}`
+- Add logo of FANS to the README https://github.com/DataAnalyticsEngineering/FANS/pull/70
+
## v0.4.1
- remove std::sqrt from constexpr - failed on Clang https://github.com/DataAnalyticsEngineering/FANS/pull/64
diff --git a/CMakeLists.txt b/CMakeLists.txt
index 4294bfd..45a23c3 100644
--- a/CMakeLists.txt
+++ b/CMakeLists.txt
@@ -5,7 +5,7 @@ cmake_minimum_required(VERSION 3.21)
# ##############################################################################
project(FANS
- VERSION 0.4.1
+ VERSION 0.4.2
LANGUAGES C CXX
)
diff --git a/FANS_Dashboard/pyproject.toml b/FANS_Dashboard/pyproject.toml
index c9f5287..e1ef4c8 100644
--- a/FANS_Dashboard/pyproject.toml
+++ b/FANS_Dashboard/pyproject.toml
@@ -4,19 +4,15 @@ build-backend = "hatchling.build"
[project]
name = "fans-dashboard"
-version = "0.4.1"
-requires-python = ">=3.13"
+version = "0.4.2"
+requires-python = ">=3.9"
dependencies = [
- "numpy>=2.2.5,<3",
- "h5py>=3.13.0,<4",
- "plotly>=6.0.1,<7",
- "lxml>=5.4.0,<6",
- "nbformat>=5.10.4,<6",
- "matplotlib>=3.10.1,<4",
- "scipy>=1.15.2,<2",
- "meshio>=5.3.5,<6",
- "ipykernel>=6.29.5,<7",
- "nbclient>=0.10.2,<0.11",
+ "numpy",
+ "h5py",
+ "plotly",
+ "lxml",
+ "scipy",
+ "meshio",
]
[tool.hatch.build.targets.wheel]
diff --git a/README.md b/README.md
index e900a83..94884a3 100644
--- a/README.md
+++ b/README.md
@@ -3,7 +3,7 @@
Fourier-Accelerated Nodal Solver (FANS) is an FFT-based homogenization solver for microscale multiphysics problems. FANS is written in C++, built using CMake, and it has MPI parallelization.
-
+
## Table of contents
@@ -17,7 +17,7 @@ Fourier-Accelerated Nodal Solver (FANS) is an FFT-based homogenization solver fo
FANS has the following dependencies:
-- A C++ compiler (e.g. GCC, Clang, etc.)
+- A C++ compiler (e.g., GCC, Clang, etc.)
- CMake (version 3.21 or higher)
- Git (for cloning this repo)
- MPI (mpicc and mpic++)
@@ -27,7 +27,7 @@ FANS has the following dependencies:
### Installing dependencies
-- On Debian based systems, we recommend installing the dependencies using using `apt`,
+- On Debian-based systems, we recommend installing the dependencies using `apt`,
```bash
apt-get install \
@@ -51,10 +51,10 @@ FANS has the following dependencies:
### Setting up a Python environment
-Also, we recommend to set up a Python virtual environment for the [`FANS_Dashboard.ipynb`](FANS_Dashboard/FANS_Dashboard.ipynb) via [pixi](https://pixi.sh/) with all required Python dependencies in an isolated environment:
+Also, we recommend setting up a Python virtual environment for the [`FANS_Dashboard.ipynb`](FANS_Dashboard/FANS_Dashboard.ipynb) via [pixi](https://pixi.sh/) with all required Python dependencies in an isolated environment:
```bash
-# Install pixi if not done already
+# Install Pixi if not done already,
curl -fsSL https://pixi.sh/install.sh | sh
# Create and activate the environment
@@ -79,7 +79,7 @@ Spack is a package manager designed for high-performance computing environments.
spack install fftw +mpi
```
- Additionally, optimized FFTW implementations can be used depending on your system's architecture, for example `amdfftw` (For AMD systems) or `cray-fftw` (For Cray systems) or `fujitsu-fftw` (For Fujitsu systems).
+ Additionally, optimized FFTW implementations can be used depending on your system's architecture, for example `amdfftw` (For AMD systems) or `cray-fftw` (For Cray systems), or `fujitsu-fftw` (For Fujitsu systems).
3. **Load Dependencies** Once dependencies are installed, load them before building:
@@ -142,7 +142,7 @@ Install FANS (system-wide) using the following options:
[](https://anaconda.org/conda-forge/fans)
[](https://anaconda.org/conda-forge/fans)
-FANS is also available as a conda-package on [conda-forge/fans](https://anaconda.org/conda-forge/fans). No dependencies have to be manually installed for it to work.
+FANS is also available as a conda package on [conda-forge/fans](https://anaconda.org/conda-forge/fans). No dependencies have to be manually installed for it to work.
It can be installed via
```bash
@@ -153,7 +153,7 @@ exposing the executable `FANS`.
## Input File Format
-FANS requires a JSON input file specifying the problem parameters. Example input files can be found in the [`test/input_files`](test/input_files) directory. It is recommended to use these files as a reference to create your own input file.
+FANS requires a JSON input file specifying the problem parameters. Example input files can be found in the [`test/input_files`](test/input_files) directory. It is recommended to use these files as a reference to create your input file.
### Microstructure Definition
@@ -167,7 +167,7 @@ FANS requires a JSON input file specifying the problem parameters. Example input
- `filepath`: This specifies the path to the HDF5 file that contains the microstructure data.
- `datasetname`: This is the path within the HDF5 file to the specific dataset that represents the microstructure.
-- `L`: Microstructure length defines the physical dimensions of the microstructure in the x, y, and z directions.
+- `L`: Microstructure length defines the physical dimensions of the microstructure in the $x$, $y$, and $z$ directions.
### Problem Type and Material Model
@@ -189,7 +189,7 @@ FANS requires a JSON input file specifying the problem parameters. Example input
- `LinearElasticIsotropic` for linear isotropic elastic material model
- `LinearElasticTriclinic` for linear triclinic elastic material model
- `PseudoPlasticLinearHardening` / `PseudoPlasticNonLinearHardening` for plasticity mimicking model with linear/nonlinear hardening
- - `J2ViscoPlastic_LinearIsotropicHardening` / `J2ViscoPlastic_NonLinearIsotropicHardening` for rate independent / dependent J2 plasticity model with kinematic and linear/nonlinear isotropic hardening.
+ - `J2ViscoPlastic_LinearIsotropicHardening` / `J2ViscoPlastic_NonLinearIsotropicHardening` for rate-independent / dependent J2 plasticity model with kinematic and linear/nonlinear isotropic hardening.
- `material_properties`: This provides the necessary material parameters for the chosen material model. For thermal problems, you might specify `conductivity`, while mechanical problems might require `bulk_modulus`, `shear_modulus`, and more properties for advanced material models. These properties can be defined as arrays to represent multiple phases within the microstructure.
@@ -206,7 +206,7 @@ FANS requires a JSON input file specifying the problem parameters. Example input
```
- `method`: This indicates the numerical method to be used for solving the system of equations. `cg` stands for the Conjugate Gradient method, and `fp` stands for the Fixed Point method.
-- `error_parameters`: This section defines the error parameters for the solver. Error control is applied on the finite element nodal residual of the problem.
+- `error_parameters`: This section defines the error parameters for the solver. Error control is applied to the finite element nodal residual of the problem.
- `measure`: Specifies the norm used to measure the error. Options include `Linfinity`, `L1`, or `L2`.
- `type`: Defines the type of error measurement. Options are `absolute` or `relative`.
- `tolerance`: Sets the tolerance level for the solver, defining the convergence criterion based on the chosen error measure. The solver iterates until the solution meets this tolerance.
@@ -235,7 +235,7 @@ FANS requires a JSON input file specifying the problem parameters. Example input
- For `thermal` problems, the array typically has 3 components, representing the temperature gradients in the $x$, $y$, and $z$ directions.
- For `mechanical` problems, the array must have 6 components, corresponding to the components of the strain tensor in Mandel notation (e.g., $[\varepsilon_{11}, \varepsilon_{22}, \varepsilon_{33}, \sqrt{2}\varepsilon_{12}, \sqrt{2}\varepsilon_{13}, \sqrt{2}\varepsilon_{23}]$).
-In the case of path/time-dependent loading as shown, for example as in plasticity problems, the `macroscale_loading` array can include multiple steps with corresponding loading conditions.
+In the case of path/time-dependent loading, as shown, for example, in plasticity problems, the `macroscale_loading` array can include multiple steps with corresponding loading conditions.
FANS also supports mixed boundary conditions, where some components can be strain-controlled while others are stress-controlled:
@@ -257,26 +257,26 @@ FANS also supports mixed boundary conditions, where some components can be strai
"microstructure", "displacement", "displacement_fluctuation", "stress", "strain"]
```
-- `results`: This array lists the quantities that should be stored into the results HDF5 file during the simulation. Each string in the array corresponds to a specific result:
+- `results`: This array lists the quantities that should be stored in the results HDF5 file during the simulation. Each string in the array corresponds to a specific result:
- `stress_average` and `strain_average`: Volume averaged- homogenized stress and strain over the entire microstructure.
- - `absolute_error`: The L-infinity error of finite element nodal residual at each iteration.
+ - `absolute_error`: The L-infinity error of the finite element nodal residual at each iteration.
- `phase_stress_average` and `phase_strain_average`: Volume averaged- homogenized stress and strain for each phase within the microstructure.
- `microstructure`: The original microstructure data.
- `displacement`: The displacement field (for mechanical problems) and temperature field (for thermal problems) at each voxel in the microstructure.
- `displacement_fluctuation`: The periodic displacement fluctuation field (for mechanical problems) and periodic temperature fluctuation field (for thermal problems at each voxel in the microstructure).
- `stress` and `strain`: The stress and strain fields at each voxel in the microstructure.
-- Additional material model specific results can be included depending on the problem type and material model.
+- Additional material model-specific results can be included depending on the problem type and material model.
## Acknowledgements
-Funded by Deutsche Forschungsgemeinschaft (DFG, German Research Foundation) under Germany’s Excellence Strategy - EXC 2075 – 390740016. Contributions by Felix Fritzen are funded by Deutsche Forschungsgemeinschaft (DFG, German Research Foundation) within the Heisenberg program - DFG-FR2702/8 - 406068690; DFG-FR2702/10 - 517847245 and through NFDI-MatWerk - NFDI 38/1 - 460247524. We acknowledge the support by the Stuttgart Center for Simulation Science ([SimTech](https://www.simtech.uni-stuttgart.de/)).
+Funded by Deutsche Forschungsgemeinschaft (DFG, German Research Foundation) under Germany’s Excellence Strategy - EXC 2075 – 390740016. Contributions by Felix Fritzen are funded by Deutsche Forschungsgemeinschaft (DFG, German Research Foundation) within the Heisenberg program - DFG-FR2702/8 - 406068690; DFG-FR2702/10 - 517847245 and through NFDI-MatWerk - NFDI 38/1 - 460247524. We acknowledge the support of the Stuttgart Center for Simulation Science ([SimTech](https://www.simtech.uni-stuttgart.de/)).
## Contributors
- [Sanath Keshav](https://github.com/sanathkeshav)
-- [Florian Rieg](about:blank)
+- [Florian Rieg](https://github.com/scylent)
- [Ishaan Desai](https://github.com/IshaanDesai)
- [Moritz Sigg](https://github.com/siggmo)
- [Claudius Haag](https://github.com/claudiushaag)
diff --git a/docs/images/FANS_example.png b/docs/images/FANS_example.png
deleted file mode 100644
index 3e49c99..0000000
Binary files a/docs/images/FANS_example.png and /dev/null differ
diff --git a/docs/images/FANS_logo.png b/docs/images/FANS_logo.png
new file mode 100644
index 0000000..f01b935
Binary files /dev/null and b/docs/images/FANS_logo.png differ
diff --git a/pixi.lock b/pixi.lock
index 822be9d..bf7ba4b 100644
--- a/pixi.lock
+++ b/pixi.lock
@@ -9,449 +9,418 @@ environments:
linux-64:
- conda: https://conda.anaconda.org/conda-forge/linux-64/_libgcc_mutex-0.1-conda_forge.tar.bz2
- conda: https://conda.anaconda.org/conda-forge/linux-64/_openmp_mutex-4.5-2_gnu.tar.bz2
- - conda: https://conda.anaconda.org/conda-forge/noarch/beartype-0.20.2-pyhd8ed1ab_1.conda
+ - conda: https://conda.anaconda.org/conda-forge/noarch/asttokens-3.0.0-pyhd8ed1ab_1.conda
+ - conda: https://conda.anaconda.org/conda-forge/noarch/beartype-0.21.0-pyhd8ed1ab_0.conda
- conda: https://conda.anaconda.org/conda-forge/linux-64/bzip2-1.0.8-h4bc722e_7.conda
- - conda: https://conda.anaconda.org/conda-forge/noarch/ca-certificates-2025.4.26-hbd8a1cb_0.conda
+ - conda: https://conda.anaconda.org/conda-forge/noarch/ca-certificates-2025.6.15-hbd8a1cb_0.conda
- conda: https://conda.anaconda.org/conda-forge/linux-64/cffi-1.17.1-py313hfab6e84_0.conda
- conda: https://conda.anaconda.org/conda-forge/noarch/cfgv-3.3.1-pyhd8ed1ab_1.conda
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- - conda: https://conda.anaconda.org/conda-forge/noarch/cpython-3.13.3-py313hd8ed1ab_101.conda
+ - conda: https://conda.anaconda.org/conda-forge/noarch/comm-0.2.2-pyhd8ed1ab_1.conda
+ - conda: https://conda.anaconda.org/conda-forge/noarch/cpython-3.13.5-py313hd8ed1ab_102.conda
+ - conda: https://conda.anaconda.org/conda-forge/linux-64/debugpy-1.8.14-py313h46c70d0_0.conda
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+ - python_abi 3.13.* *_cp313
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+ license: Apache-2.0
+ license_family: Apache
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+ - pkg:pypi/tornado?source=hash-mapping
+ size: 878044
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+ - python >=3.9
+ license: BSD-3-Clause
+ license_family: BSD
+ purls:
+ - pkg:pypi/traitlets?source=hash-mapping
+ size: 110051
+ timestamp: 1733367480074
+- conda: https://conda.anaconda.org/conda-forge/noarch/typing_extensions-4.14.0-pyhe01879c_0.conda
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depends:
- python >=3.9
- python
license: PSF-2.0
license_family: PSF
purls:
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- size: 52189
- timestamp: 1744302253997
+ - pkg:pypi/typing-extensions?source=hash-mapping
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+ timestamp: 1748959427551
- conda: https://conda.anaconda.org/conda-forge/noarch/tzdata-2025b-h78e105d_0.conda
sha256: 5aaa366385d716557e365f0a4e9c3fca43ba196872abbbe3d56bb610d131e192
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- pkg:pypi/ukkonen?source=hash-mapping
size: 17210
timestamp: 1725784604368
-- conda: https://conda.anaconda.org/conda-forge/win-64/vc-14.3-h2b53caa_26.conda
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depends:
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license: BSD-3-Clause
license_family: BSD
purls: []
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+ size: 17914
+ timestamp: 1750371462857
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depends:
- ucrt >=10.0.20348.0
constrains:
- - vs2015_runtime 14.42.34438.* *_26
+ - vs2015_runtime 14.44.35208.* *_26
license: LicenseRef-MicrosoftVisualCpp2015-2022Runtime
license_family: Proprietary
purls: []
- size: 750733
- timestamp: 1743195092905
+ size: 756109
+ timestamp: 1750371459116
- conda: https://conda.anaconda.org/conda-forge/noarch/virtualenv-20.31.2-pyhd8ed1ab_0.conda
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md5: c0600c1b374efa7a1ff444befee108ca
@@ -3892,22 +3534,27 @@ packages:
- pkg:pypi/virtualenv?source=hash-mapping
size: 4133755
timestamp: 1746781585998
-- conda: https://conda.anaconda.org/conda-forge/win-64/vs2015_runtime-14.42.34438-h7142326_26.conda
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license: BSD-3-Clause
license_family: BSD
purls: []
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-- pypi: https://files.pythonhosted.org/packages/fd/84/fd2ba7aafacbad3c4201d395674fc6348826569da3c0937e75505ead3528/wcwidth-0.2.13-py2.py3-none-any.whl
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- version: 0.2.13
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- requires_dist:
- - backports-functools-lru-cache>=1.2.1 ; python_full_version < '3.2'
+ size: 17888
+ timestamp: 1750371463202
+- conda: https://conda.anaconda.org/conda-forge/noarch/wcwidth-0.2.13-pyhd8ed1ab_1.conda
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+ license: MIT
+ license_family: MIT
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- conda: https://conda.anaconda.org/conda-forge/linux-64/yaml-0.2.5-h7f98852_2.tar.bz2
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purls: []
size: 63274
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+ license: MPL-2.0
+ license_family: MOZILLA
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+ license: MPL-2.0
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+ license: MPL-2.0
+ license_family: MOZILLA
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diff --git a/pixi.toml b/pixi.toml
index 5d065c1..2ba4ca8 100644
--- a/pixi.toml
+++ b/pixi.toml
@@ -4,12 +4,13 @@ name = "FANS"
platforms = ["linux-64", "win-64", "osx-64", "osx-arm64"]
[dependencies]
-python = ">=3.13.3,<3.14"
-pytest = ">=8.3.5,<9"
+python = ">=3.13.5,<3.14"
+pytest = ">=8.4.1,<9"
pre-commit = ">=4.2.0,<5"
sympy = ">=1.14.0,<2"
quaternion = ">=2024.0.8,<2025"
-beartype = ">=0.20.2,<0.21"
+beartype = ">=0.21.0,<0.22"
+ipykernel = ">=6.29.5,<7"
[pypi-dependencies]
@@ -21,3 +22,4 @@ pyrecest = {git = "https://github.com/FlorianPfaff/pyRecEst.git"}
[tasks]
test = "pytest -v -s"
precommit = "pre-commit run --all-files"
+h52xdmf = { args = ["file"], cmd = "cd \"$INIT_CWD\" && python -m fans_dashboard.plotting.h52xdmf -t -v {{file}}" }
diff --git a/test/README.md b/test/README.md
index 147e323..c2dbaac 100644
--- a/test/README.md
+++ b/test/README.md
@@ -51,3 +51,9 @@ Each test case has corresponding input JSON files in the `input_files/` director
```bash
mpiexec -n 2 ./FANS input_files/test_LinearElastic.json test_results.h5
```
+
+To quickly visualize the test results, and accompanying XDMF for the HDF5 output can be generated which can be directly opened in ParaView for 3D visualization and analysis:
+
+```bash
+pixi run h52xdmf test_results.h5
+```