Accurate modeling of inter- and intra-molecular interactions in 1,4-dihydroxynaphthalene in the 0.5-6 terahertz region

• Main Authors: Ponseca, C., Cadatal, M., Pobre, Romeric F., Quiroga, Reuben, Murakami, H., Ono, S., Sarukura, N., Nishizawa, J., Suto, K., Sasaki, T., Tanno, T., Tominaga, K.
• Format: text
• Published: Animo Repository 2007
• Subjects: Radio frequency; Molecular structure; Terahertz spectroscopy; Physics
• Online Access: https://animorepository.dlsu.edu.ph/faculty_research/3568; https://animorepository.dlsu.edu.ph/context/faculty_research/article/4570/type/native/viewcontent/CLEO.2007.4452448
• Institution: De La Salle University

Semi-empirical calculations successfully predicted the terahertz (THz) absorption spectrum associated with intra- and intermolecular interactions in 1,4-dihydroxynaphthalene. Results are in excellent agreement with spectroscopy data in the 0.5-6 THz region using GaP wave THz source. © 2006 Optical S...