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Eric Sonnenthal
moderator
Eric_Sonnenthal
TOUGHREACT Developer
Lawrence Berkeley Nat. lab
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Joined
Thu Sep 11 23:14:02 UTC 2014
143
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Latest Posts
Re: Data file Problem No.6 (*Case6_50kg_DP*) needed
Hi Masoud, Case6_50kg_DP is a test problem for ECO2n V2, which has not yet been ported to TOUGHREACT. Probably your best option is to modify one of the existing ECO2n sample problems.…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
8 yrs ago
TOUGH2
Reported - view
Re: Data file Problem No.6 (*Case6_50kg_DP*) needed
Hi Masoud, I am looking into finding this test problem, and will get back to you as soon as possible. This is not a problem I have used with TOUGHREACT,…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
8 yrs ago
TOUGH2
Reported - view
Re: Compilation mistake
Which version of gfortran? Try v6.
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
8 yrs ago
TOUGH2
Reported - view
Re: Cooling cell
Bergur, One more thing -- Did you try the same problem with the restart turning the reactive transport off (just flow)? Eric
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
8 yrs ago
TOUGHREACT
Reported - view
Re: Cooling cell
Hi Bergur, Yes, this is a little funny. Which EOS are you using? I don't think this has anything to do with chemistry, but you may want to check that on restart the porosity didn't increase too much.…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
8 yrs ago
TOUGHREACT
Reported - view
Re: Is there a limitation in the number of grid blocks to be printed out?
Hi Jaeshik, The "plot.out or *.tec file" file is meant to write out the data at every grid block at a relatively limited number of specific times (<=100) for both the flow and chemical outputs.…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
8 yrs ago
TOUGHREACT
Reported - view
Re: Is there a limitation in the number of grid blocks to be printed out?
Jaeshik, In TOUGHREACT V3-OMP, there is a limit of 200 grid blocks to print out time information (solute.inp). Maybe 100 in a row is too many. I think the code looks for 15 on a row, then repeated.…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
8 yrs ago
TOUGHREACT
Reported - view
Re: Mass Balance for trace gases in TOUGHREACT V3-OMP
Lennard, I checked the mass balance routine, and it does not include the trace gases. Actually, I never thought of updating this routine when I put in the trace gases option because I haven't looked…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
9 yrs ago
TOUGHREACT
Reported - view
Re: zero flux for ions at boundary condition
Anthony, I'm not sure which would be the best references on this, but any papers on evapotranspiration, combined with papers on chloride in infiltrating water vs.…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
9 yrs ago
TOUGHREACT
Reported - view
Re: zero flux for ions at boundary condition
Anthony, If I had seen Stefan's post, I could have referred to his perfect description! Unfortunately, the capillary suction approach does not give correct results for simulating evaporation when…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
9 yrs ago
TOUGHREACT
Reported - view
Re: zero flux for ions at boundary condition
Anthony, If you want to simulate drying so that there is only a flux of water into the air and not ions, then you should do it with eos4, setting a very low relative humidity in the boundary block…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
9 yrs ago
TOUGHREACT
Reported - view
Re: zero flux for ions at boundary condition
Anthony, When you say "get out of the porous medium", the ions can "get out" by advection and or diffusion. Also, there is drying by evaporation and drying by capillary suction,…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
9 yrs ago
TOUGHREACT
Reported - view
Re: Mass Balance for trace gases in TOUGHREACT V3-OMP
Hi Lennard, There should not be a problem in the actual mass injected of trace gases. However, if you use the mass balance output file to check for mass balance,…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
9 yrs ago
TOUGHREACT
Reported - view
Re: initial volume fraction of the mineral
Actually, if the values are greater than one, they are normalized to one. This is done soon after input. This should not result in a mass balance error.…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
10 yrs ago
TOUGHREACT
Reported - view
Re: Input conversion error, unit 33
Hi Luanjing, Unit 33 refers to the flow.inp file. Input conversion error means there is a character, real number, or integer in a place where it requires a different type of input.…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
10 yrs ago
TOUGHREACT
Reported - view
Re: TR-V3-OMP: Composition of gas zone / VOLG
Hi Lennard, After talking with Nic Spycher, and looking at your problem again, I need to modify my previous answer. The initial gas concentration is still partial pressure for all modules (as in V2),…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
10 yrs ago
TOUGHREACT
Reported - view
Re: initial volume fraction of the mineral
Hi Tran, In addition, if the sum of the initial volume fractions is greater than one, the volume fractions are normalized so that the total is equal to one. Eric
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
10 yrs ago
TOUGHREACT
Reported - view
Re: TR-V3-OMP: Composition of gas zone / VOLG
Hi Lennard, Yes, you are right that it should say "volume fraction". The manual and sample problem headers need to be updated. I don't think the description for VOLG was correct in the V2 manual,…
Eric Sonnenthal
moderator
TOUGHREACT Developer
Eric_Sonnenthal
10 yrs ago
TOUGHREACT
Reported - view
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