Matches in SemOpenAlex for { <https://semopenalex.org/work/W2887601900> ?p ?o ?g. }
- W2887601900 endingPage "10058" @default.
- W2887601900 startingPage "10050" @default.
- W2887601900 abstract "Competitive forces exist in multicomponent solutions, and within electrolytes they consist of both ion-solvent and solvent-solvent interactions. These can influence a myriad of processes, including ligand complexation. In the case of water/alcohol solutions, recent work revealed an interesting dilemma regarding the overall solution dynamics and organization as compared to solute-solvent interactions. This is particularly true for highly charged ions in solution, whose ion-solvent interactions were demonstrated to be highly sensitive to the composition of the immediate solvation environment. Faster solvent exchange should be observed about the ion, considering that second-order Møller-Plesset perturbation theory predicts an average decrease in ion-solvent dissociation energy when methanol enters the first solvation shell of Cm3+(aq). Yet the addition of methanol to water causes the dynamic features of the hydrogen-bond network of the entire solution to slow. The apparent competition between these contrary forces was examined using a combination of electronic structure calculations with both ab initio and classical molecular dynamics simulations, using binary water/methanol solutions and Cm3+ as a representative solute. This combination of theoretical methods predicts that, among the competitive effects of the solvent-solvent and ion-solvent interactions, the solution-phase dynamics imparted by the addition of methanol to water kinetically restricts the solvation exchange rates about Cm3+ in these binary solutions." @default.
- W2887601900 created "2018-08-22" @default.
- W2887601900 creator A5017457971 @default.
- W2887601900 creator A5027443684 @default.
- W2887601900 creator A5048639368 @default.
- W2887601900 creator A5086955828 @default.
- W2887601900 date "2018-08-01" @default.
- W2887601900 modified "2023-10-15" @default.
- W2887601900 title "Competitive Interactions Within Cm(III) Solvation in Binary Water/Methanol Solutions" @default.
- W2887601900 cites W1592320036 @default.
- W2887601900 cites W1768645616 @default.
- W2887601900 cites W1965092590 @default.
- W2887601900 cites W1969421835 @default.
- W2887601900 cites W1972758026 @default.
- W2887601900 cites W1975031643 @default.
- W2887601900 cites W1981368803 @default.
- W2887601900 cites W1983923204 @default.
- W2887601900 cites W1984239226 @default.
- W2887601900 cites W1985067703 @default.
- W2887601900 cites W1985272737 @default.
- W2887601900 cites W1985371575 @default.
- W2887601900 cites W1985871682 @default.
- W2887601900 cites W1991794210 @default.
- W2887601900 cites W1995960756 @default.
- W2887601900 cites W1996919868 @default.
- W2887601900 cites W1998874002 @default.
- W2887601900 cites W2003489405 @default.
- W2887601900 cites W2003949305 @default.
- W2887601900 cites W2009751711 @default.
- W2887601900 cites W2010587930 @default.
- W2887601900 cites W2013754612 @default.
- W2887601900 cites W2015597101 @default.
- W2887601900 cites W2017196167 @default.
- W2887601900 cites W2018982195 @default.
- W2887601900 cites W2019183592 @default.
- W2887601900 cites W2019381799 @default.
- W2887601900 cites W2023271753 @default.
- W2887601900 cites W2025004371 @default.
- W2887601900 cites W2029945561 @default.
- W2887601900 cites W2034333249 @default.
- W2887601900 cites W2037540578 @default.
- W2887601900 cites W2037907123 @default.
- W2887601900 cites W2040539152 @default.
- W2887601900 cites W2041049135 @default.
- W2887601900 cites W2044940178 @default.
- W2887601900 cites W2045596260 @default.
- W2887601900 cites W2046001409 @default.
- W2887601900 cites W2051381895 @default.
- W2887601900 cites W2053247217 @default.
- W2887601900 cites W2054339391 @default.
- W2887601900 cites W2058657879 @default.
- W2887601900 cites W2059270907 @default.
- W2887601900 cites W2060720164 @default.
- W2887601900 cites W2064998085 @default.
- W2887601900 cites W2065807196 @default.
- W2887601900 cites W2066636486 @default.
- W2887601900 cites W2066737665 @default.
- W2887601900 cites W2068029137 @default.
- W2887601900 cites W2068656929 @default.
- W2887601900 cites W2072841939 @default.
- W2887601900 cites W2074099769 @default.
- W2887601900 cites W2078479676 @default.
- W2887601900 cites W2078492642 @default.
- W2887601900 cites W2082018233 @default.
- W2887601900 cites W2082711435 @default.
- W2887601900 cites W2085499449 @default.
- W2887601900 cites W2092532075 @default.
- W2887601900 cites W2093259727 @default.
- W2887601900 cites W2096153455 @default.
- W2887601900 cites W2121862404 @default.
- W2887601900 cites W2122974066 @default.
- W2887601900 cites W2136937238 @default.
- W2887601900 cites W2139531945 @default.
- W2887601900 cites W2140537049 @default.
- W2887601900 cites W2143981217 @default.
- W2887601900 cites W2152802025 @default.
- W2887601900 cites W2166943899 @default.
- W2887601900 cites W2313045141 @default.
- W2887601900 cites W2326256701 @default.
- W2887601900 cites W2328779742 @default.
- W2887601900 cites W2331503261 @default.
- W2887601900 cites W2333645756 @default.
- W2887601900 cites W2334439144 @default.
- W2887601900 cites W2343554524 @default.
- W2887601900 cites W234609201 @default.
- W2887601900 cites W2414180986 @default.
- W2887601900 cites W2950728054 @default.
- W2887601900 cites W4211250518 @default.
- W2887601900 cites W4239227123 @default.
- W2887601900 doi "https://doi.org/10.1021/acs.inorgchem.8b01214" @default.
- W2887601900 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/30067015" @default.
- W2887601900 hasPublicationYear "2018" @default.
- W2887601900 type Work @default.
- W2887601900 sameAs 2887601900 @default.
- W2887601900 citedByCount "7" @default.
- W2887601900 countsByYear W28876019002018 @default.
- W2887601900 countsByYear W28876019002019 @default.
- W2887601900 countsByYear W28876019002020 @default.