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Relative adsorption, interfacial enrichment, and interface thickness.#64

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prehner merged 4 commits into
feos-org:mainfrom
RolfStierle:dft_vle_profile_adsorption
Dec 1, 2022
Merged

Relative adsorption, interfacial enrichment, and interface thickness.#64
prehner merged 4 commits into
feos-org:mainfrom
RolfStierle:dft_vle_profile_adsorption

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@RolfStierle

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…(90-10; just in Python interface, otherwise general) implemented.

…(90-10; just in Python interface, otherwise general) implemented.
Comment thread feos-dft/src/interface/mod.rs Outdated
Comment thread feos-dft/src/interface/mod.rs
Comment thread feos-dft/src/python/interface/mod.rs
Comment thread feos-dft/src/python/interface/mod.rs Outdated
Comment thread tests/pcsaft/dft.rs Outdated
Comment thread feos-dft/src/interface/mod.rs Outdated
Comment thread feos-dft/src/interface/mod.rs Outdated
Comment thread feos-dft/src/interface/mod.rs Outdated
Comment thread feos-dft/src/python/interface/mod.rs
@prehner prehner added the DFT DFT related feature or issue label Nov 11, 2022
@RolfStierle
RolfStierle requested review from g-bauer and prehner and removed request for g-bauer and prehner November 30, 2022 11:12
@prehner

prehner commented Nov 30, 2022

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Thank you for the revisions! It looks like a nice addition. Can you remove the commented out lines of code? I think without context they are not helpful. Finally please add a changelog entry to the changelog of feos-dft (careful, feos and feos-dft have their own changelogs).

@prehner
prehner merged commit 8f0ebcc into feos-org:main Dec 1, 2022
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