Dear all,
I am new to Theriak-Domino and try to recalculate the diagrams in de Capitani (2010). I got all the same results as in Fig.2, except for Fig.2e "Si pfu in Ms", which is related to the isoline calculation.
I tried different ways to input the corresponding phase and data, but none of them worked.The Inputs and results are as follows:
(Name Key Nr min max step)
1. Muscovite Si 1 3 3.4 0.04 ------got no line in the diagram
2. Muscovite EI(Z) 1 3 3.4 0.04 ------got no line in the diagram (I guessed Z might be the defined site (Si, Al) name of Ms, which can be found in database file jun92d,bs)
3. Muscovite EI(Si) 1 3 3.4 0.04 ------got no line in the diagram
4. Muscovite Silicon 1 3 3.4 0.04 ------got no line in the diagram
5. Muscovite Z(Silicon) 1 3 3.4 0.04 ------got no line in the diagram
For comparison, I used Al to check if it worked, but still got nothing.
6. Muscovite Al 2 0.6 1 0.04 ------got no line in the diagram
I also used "list" to check the available phases, found that abbrivation Si represented Sillimanite. Maybe this is the reason why no single line could be calculated, but I am not sure.
Anybody has clues for this issue? Thanks in advance.
Tao.
What Input should be used for calculate the isolines of
Re: What Input should be used for calculate the isolines of
Hi Tao,
Look at this thread https://research-talk.org/viewtopic.php?f=4&t=18. There, in the end, there is an answer to your problem
All the best
Jacek
Look at this thread https://research-talk.org/viewtopic.php?f=4&t=18. There, in the end, there is an answer to your problem
All the best
Jacek
Re: What Input should be used for calculate the isolines of
Hi Jacek,
Thank you! But still I didn't get it after I saw that thread. What did you mean " when I'm not using scripts chemical composition of the sysem is read from THERIN file"? Then in what way you input the phase and data?
I didn't use script file and all the compositions are from THERIN, even when I tried Pierre's method it still got nothing.
Thank you! But still I didn't get it after I saw that thread. What did you mean " when I'm not using scripts chemical composition of the sysem is read from THERIN file"? Then in what way you input the phase and data?
I didn't use script file and all the compositions are from THERIN, even when I tried Pierre's method it still got nothing.
Re: What Input should be used for calculate the isolines of
Hi Jacek,
Finally I solved the problem. There're two key points in the Input (Name Key Nr min max step): 1. The Name must be the mineral, not the endmember of the mineral; 2. The Key for per formular unit is Element+pfu, like Pierre suggusted in the thread you showed me. For this case, it should be sipfu.
Thus, the right way to Input for calculating Sipfu of Ms is:
White Mica sipfu 1 3 3.4 0.04 (Note: The phase is White Mica not Muscovite)
Finally I solved the problem. There're two key points in the Input (Name Key Nr min max step): 1. The Name must be the mineral, not the endmember of the mineral; 2. The Key for per formular unit is Element+pfu, like Pierre suggusted in the thread you showed me. For this case, it should be sipfu.
Thus, the right way to Input for calculating Sipfu of Ms is:
White Mica sipfu 1 3 3.4 0.04 (Note: The phase is White Mica not Muscovite)
Re: What Input should be used for calculate the isolines of
Tao,
I am using scripts. Here is an example of such a script. Hopefully, it will help.
Jacek
script.script01d.txt
script01d.plt
JUN92d.bs
I am using scripts. Here is an example of such a script. Hopefully, it will help.
Jacek
script.script01d.txt
script01d.plt
JUN92d.bs
1.0000 300 0.010000 0.1000000E-08 0.1000000E-06 0.1000000E+01 0.1000000E-03 25 25 500
0 SI(61.8085)AL(22.6557)FE(4.9861)MG(2.4803)MN(0.2855)CA(0.6044)NA(2.1119)K(4.4345)TI(0.6330)H(100)O(?) * sample PK007b (core of grt I)
TC 350 650
P 3000 25000
WHITE MICA sipfu 1 3.00 3.80 0.02
1
0.0000000E+00 0.0000000E+00
_script01d_pix
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