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misidentified elements by ase #142

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JFRudzinski opened this issue Jan 22, 2025 · 0 comments
Open

misidentified elements by ase #142

JFRudzinski opened this issue Jan 22, 2025 · 0 comments

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@JFRudzinski
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I noticed that the check for "real" elements sometimes gives back false positives, e.g., when the labels are CO or P6 ase sets the species label as C and P
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@JFRudzinski