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. 2025 Aug 13;15(35):28703–28720. doi: 10.1039/d5ra04844c

Table 5. Comparison of band gap values for the adsorbent and adsorbent–gas complexes.

Structure Band gap (eV)
BP 0.877
HF + BP 0.879
H2S + BP 0.866
Al-BP 0.783
HF + Al-BP 1.007
H2S + Al-BP 0.991
Ti-BP 0.000
HF + Ti-BP 0.000
H2S + Ti-BP 0.000