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Vibrational Modes and Phonon and Thermodynamic Properties of the Metaboric Acid Polymorphs alpha-, beta-, and gamma-(BOH)(3)O-3 within a Density Functional Theory Framework

, , , , and . JOURNAL OF PHYSICAL CHEMISTRY A, 122 (38): 7628-7645 (2018)
DOI: 10.1021/acs.jpca.8b05238

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