First-principles approach to rotational-vibrational frequencies and infrared intensity for H 2 adsorbed in nanoporous materials

Title: First-principles approach to rotational-vibrational frequencies and infrared intensity for $H_{2}$ adsorbed in nanoporous materials

Journal Article · Thu Mar 03 00:00:00 EST 2011 · Physical Review B

DOI:https://doi.org/10.1103/PhysRevB.83.121402· OSTI ID:1099982

Kong, Lingzhu; Chabal, Yves J.; Langreth, David C.

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h_{b} (1 P)

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