Electronic properties and vibrational spectra of (NH

Autor: Santunu, Ghosh, Saif, Ullah, João P A, de Mendonça, Luciano G, Moura, Marcos G, Menezes, Leonã S, Flôres, Tiago S, Pacheco, Luiz F C, de Oliveira, Fernando, Sato, Sukarno O, Ferreira
Rok vydání: 2019
Zdroj: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy. 218
ISSN: 1873-3557
Popis: The complex crystals of the family of the Tutton's salt have been investigated through the numerous experimental and theoretical studies to understand their physical properties and their potential technological applications. In spite of the more than 60 years of research, there are very few studies about the electronic properties of Tutton's salt. In our present work, we have calculated the stability, electronic properties and the first theoretical study of band structure of the three different crystals of the Tutton's salt, ammonium nickel sulfate hexahydrate ((NH
Databáze: OpenAIRE