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Changing the default grid parameters of the package. #111

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tarjear opened this issue Nov 13, 2023 · 0 comments
Open

Changing the default grid parameters of the package. #111

tarjear opened this issue Nov 13, 2023 · 0 comments

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@tarjear
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tarjear commented Nov 13, 2023

Hi!
I'm writing my master's thesis on the hyperfine structure of Bismuth, calculated using GRASP2018. Due to the size of Bi, I need to update the grid parameters RNT, H, and N for my calculations. I've successfully changed N in the /libmod directory, but I haven't found any equivalent settings for RNT and H.
I have been inputting the non-default parameters manually, which works fine for all the programs I can script (rangular, rmcdhf, rci, rhfs), but is a bit of a bother when running rwfnestimate.

Does anyone here know of a way to change RNT and H when compiling the package?

Thanks in advance,
Tarje

UPDATE: I used sed to replace all instances of "RNT = 2.0D-06" with "RNT = 1.0D-06" and "H = 5.0D-02" with "H = 1.0D-02" in the .f90 files in src and all of its subdirectories, and recompiled. I also checked that I didn't accidentally replace some other variable ending in "H" with H = 1. If anyone has a reason for why that is a horrible idea, please let me know. I'm quite new to this.

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