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feat: Sequential ChemoMechanics Coupling #3887

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@frankfeifan frankfeifan commented Oct 29, 2025 •
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This PR will couple SinglePhaseReactiveTransport solver (#3634) with SolidMechanicsFEM in a sequential manner first. The preliminary goal is to account for the volume expansion or contraction and its resulting mechanical response (e.g., stress) due to chemical precipitation or dissolution.

  • Incorporate an inelastic strain term based on mineral reaction in the stress calculation in a CoupledSolid
  • Some integrated tests or unit tests if necessary
  • An appropriate porosity and permeability model
  • Couple with the phase-field for damage/fracture modeling (maybe another PR)

frankfeifan and others added 30 commits March 13, 2025 17:52
@frankfeifan
initial commit for adding the singlePhaseReactiveTransport
538e69d
@frankfeifan
added an 1D test
3d75862
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/frankfei/s…
4ac1454 
…inglePhaseReactiveTransport
@frankfeifan
added diffusion
23de93c
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/frankfei/s…
5b8ffb2 
…inglePhaseReactiveTransport
@frankfeifan
resolve merge conflict for logLevel issue
253cf71
@frankfeifan
enabled thermal and fixed a few bugs
39b6098
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/frankfei/s…
b0b7826 
…inglePhaseReactiveTransport
@CusiniM
feat: add HPCReact as a submodule
2b25ae8
@CusiniM
Remove old Reactive fluid.
4c3890b
@CusiniM
finally compiles
d61e980
@CusiniM
added dispatch.
9e9b518
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/frankfei/s…
f7dea2a 
…inglePhaseReactiveTransport
@frankfeifan
Merge remote-tracking branch 'origin/cusini/single-phase-reactiveflui…
7b1a758 
…d' into feature/singlePhaseReactiveTransportWithHPCReact
@frankfeifan
changed the names of some fields
d04535b
@frankfeifan
Merge branch 'feature/frankfei/singlePhaseReactiveTransport' into fea…
5ef97f2 
…ture/singlePhaseReactiveTransportWithHPCReact
@frankfeifan
plugged in the equilibrium reaction to the transport solver
11c60b2
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/singlePhas…
af066f0 
…eReactiveTransportWithHPCReact
@frankfeifan
HPCReact
94d281f
@CusiniM
Merge remote-tracking branch 'origin/develop' into cusini/single-phas…
85f8184 
…e-reactivefluid
@CusiniM
interface with mixedSystem.
38a649e
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/singlePhas…
bfa4f4e 
…eReactiveTransportWithHPCReact
@frankfeifan
Merge remote-tracking branch 'origin/cusini/single-phase-reactiveflui…
44de8ae 
…d' into feature/singlePhaseReactiveTransportWithHPCReact
@frankfeifan
enable mixed system update
98965ab
@frankfeifan
change the layout and rename some concentration arrays
776bab0
@frankfeifan
enable mixed system update
de8841b
@frankfeifan
HPCReact update
3aab47e
@frankfeifan
added a unit test
668beb2
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/singlePhas…
cbece00 
…eReactiveTransportWithHPCReact
@frankfeifan
cleaned up the code and enabled thermal fluid
b40f360
frankfeifan and others added 29 commits August 13, 2025 10:53
@frankfeifan
fix for CUDA build
e484544
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/singlePhas…
4b3b7ca 
…eReactiveTransportWithHPCReact
@frankfeifan
fixed b.c. for momas and clean up xmls.
d29bfa2
@frankfeifan
change in hpcreact
24c12dd
@frankfeifan
try to solve some compile errors
25dca54
@frankfeifan
addded both advective and diffusive cases
90d3e52
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/singlePhas…
7fb15bc 
…eReactiveTransportWithHPCReact
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/singlePhas…
da310fe 
…eReactiveTransportWithHPCReact
@frankfeifan
fixed logInfo
7f2acbf
@frankfeifan
added initial primary species array and cleaned up xmls
2f12d37
@frankfeifan
updated HPCReact
5096026
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/singlePhas…
0d33a94 
…eReactiveTransportWithHPCReact
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/singlePhas…
041234b 
…eReactiveTransportWithHPCReact
@frankfeifan
enable momas medium test case
616c340
@frankfeifan
renamed the momas input file deck folder and added the 2D problem
e920071
@frankfeifan
enabled face dirichlet and updated xmls
cbe97f9
@frankfeifan
corrections in momas medium in HPCReact
73a1d79
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/singlePhas…
379ab74 
…eReactiveTransportWithHPCReact
@frankfeifan
link to HPCReact
872efc3
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/singlePhas…
1fffddd 
…eReactiveTransportWithHPCReact
@frankfeifan
clean up for momas inputs and changed back for kinetic reaction term
31caa2a
@frankfeifan
added generic chain reaction all kinetic case
ead476d
@frankfeifan
revised unit test
280902b
@frankfeifan
uncrustify
9e25f3b
@frankfeifan
Merge remote-tracking branch 'origin/develop' into feature/singlePhas…
fce0003 
…eReactiveTransportWithHPCReact
@rrsettgast
attempted workaround for cuda error
7945028
@rrsettgast
fix cuda compile issues
78e4f45
@frankfeifan
fix compile
1671d9f
@frankfeifan
initial chemomechanics coupling and an 1D example for simple testing
7ddb0a8
@frankfeifan frankfeifan self-assigned this Oct 29, 2025
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@frankfeifan @CusiniM @rrsettgast