Вивчення H2CO•••HF комплексу сучасними методами квантової механіки

• Date: 2020
• Main Authors: Amonov, A., Murodov, G., Tokhadze, K. G., Jumabaev, A., Nurmurodova, G.
• Format: Article
• Language: English
• Published: Publishing house "Academperiodika" 2020
• Subjects: -
• Online Access: https://ujp.bitp.kiev.ua/index.php/ujp/article/view/2019614
• Journal Title: Ukrainian Journal of Physics

Our research is focused on the ab initio calculations of the equilibrium structures, binding energies, harmonic and anharmonic vibrational frequencies of a hydrogen-bonded complex, which is formed between formaldehyde H2CO and hydrogen fluoride HF, using the Gaussian 09 package of programs with full...