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Comparative DFT study of vibrational, electronic, and optical properties of energetic alkali metal salts based on nitrogen-rich 5-aminotetrazole.
Jharapla, Prathap Kumar; Mondal, Subrata; Vaitheeswaran, Ganapathy.
Afiliação
  • Jharapla PK; Advanced Centre of Research in High Energy Materials (ACRHEM), University of Hyderabad, Hyderabad, Telangana, 500046, India.
  • Mondal S; Advanced Centre of Research in High Energy Materials (ACRHEM), University of Hyderabad, Hyderabad, Telangana, 500046, India.
  • Vaitheeswaran G; School of Physics, University of Hyderabad, Hyderabad, Telangana, 500046, India.
J Comput Chem ; 42(3): 180-191, 2021 Jan 30.
Article em En | MEDLINE | ID: mdl-33135252
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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Ano de publicação: 2021 Tipo de documento: Article
Texto completo
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Texto completo: 1 Coleções: 01-internacional Base de dados: MEDLINE Idioma: En Ano de publicação: 2021 Tipo de documento: Article