Pregled bibliografske jedinice broj: 1170987
An Overview on the Dynamics in Aqueous Mixtures of Lower Alcohols
An Overview on the Dynamics in Aqueous Mixtures of Lower Alcohols // Molecular Basics of Liquids and Liquid-Based Materials / Nishiyama, Katsura ; Yamaguchi, Tsuyoshi ; Takamuku, Toshiyuki ; Yoshida, Norio (ur.).
Singapur: Springer, 2022. str. 169-193 doi:10.1007/978-981-16-5395-7_6
CROSBI ID: 1170987 Za ispravke kontaktirajte CROSBI podršku putem web obrasca
Naslov
An Overview on the Dynamics in Aqueous Mixtures of
Lower Alcohols
Autori
Lovrinčević, Bernarda ; Jukić, Ivo ; Požar, Martina
Vrsta, podvrsta i kategorija rada
Poglavlja u knjigama, znanstveni
Knjiga
Molecular Basics of Liquids and Liquid-Based Materials
Urednik/ci
Nishiyama, Katsura ; Yamaguchi, Tsuyoshi ; Takamuku, Toshiyuki ; Yoshida, Norio
Izdavač
Springer
Grad
Singapur
Godina
2022
Raspon stranica
169-193
ISBN
978-981-16-5395-7
ISSN
2197-4349
Ključne riječi
Alcohol–water mixtures ; Computer simulations ; Micro-heterogeneity ; Dynamics
Sažetak
In this chapter, we present a comparative study of dynamics in three types of alcohol–water mixtures: methanol–water, ethanol–water, and 1-propanol– water. These mixtures are known for micro- heterogeneous structure, which is usually explained by the hydrophobic hydration effect. Our main focus here is how the dynamical quantities are influenced by micro-heterogeneity and consequently, how alcohol and water dynamics changes with respect to the alcohol concentration. We discuss this especially in relation to the size of the alcohol side chain. Our molecular dynamics results reveal important differences in the vibrational, rotational, and hydrogen bond dynamics of both alcohol and water molecules.
Izvorni jezik
Engleski
Znanstvena područja
Fizika, Kemija
POVEZANOST RADA
Projekti:
HRZZ-UIP-2017-05-1863 - Dinamika u sustavima u kojima postoji mikro-segregacija (DINAMIS) (Lovrinčević, Bernarda, HRZZ - UIP-2017-05) ( CroRIS)
Ustanove:
Prirodoslovno-matematički fakultet, Split
