Molecular mechanism of crystal nucleation from solution

X Li, J Wang, T Wang, N Wang, S Zong, X Huang… - Science China …, 2021 - Springer
Nucleation from solution is fundamental to many natural and industrial processes. The
understanding of molecular mechanism of nucleation from solution is conducive to predict …

Unravelling the Mechanism of the Asymmetric Hydrogenation of Acetophenone by [RuX2(diphosphine)(1,2-diamine)] Catalysts

PA Dub, NJ Henson, RL Martin… - Journal of the American …, 2014 - ACS Publications
The mechanism of catalytic hydrogenation of acetophenone by the chiral complex trans-
[RuCl2 {(S)-binap}{(S, S)-dpen}] and KO-t-C4H9 in propan-2-ol is revised on the basis of …

Research Progress on the Molecular Mechanism of Polymorph Nucleation in Solution: A Perspective from Research Mentality and Technique

P Shi, Y Han, Z Zhu, J Gong - Crystals, 2023 - mdpi.com
Based on the importance of polymorphic regulation, the molecular mechanism of nucleation
has been widely concerned. This review begins by introducing the development and …

Can the study of self-assembly in solution lead to a good model for the nucleation pathway? The case of tolfenamic acid.

W Du, AJ Cruz-Cabeza, S Woutersen, RJ Davey… - Chemical …, 2015 - pubs.rsc.org
To further our understanding of the role of solution chemistry in directing nucleation
processes new experimental and computational data are presented on the solution and …

Insights into the Role of Solvents in Nucleation Kinetics of Glutaric Acid from Metastable Zone Widths

S Xu, Y Bu, S Jiang, P Yang… - Industrial & Engineering …, 2021 - ACS Publications
In this paper, the nucleation behavior of glutaric acid (GA) in solvents with different hydrogen-
bond donating (HBD) capabilities was studied using a metastable zone width (MSZW) …

Polymorph-Selective Role of Hydrogen Bonding and π–π Stacking in p-Aminobenzoic Acid Solutions

R Bobrovs, L Drunka, AA Auzins… - Crystal Growth & …, 2020 - ACS Publications
Understanding molecular self-association in solution is vital for uncovering polymorph-
selective crystal nucleation pathways. In this paper, we combine solution NMR spectroscopy …

Reactivity of proton sources with a nickel hydride complex in acetonitrile: implications for the study of fuel-forming catalysts

ES Rountree, JL Dempsey - Inorganic chemistry, 2016 - ACS Publications
The reactivity of the nickel hydride complex [HNi (P2PhN2Ph) 2]+(P2PhN2Ph= 1, 3, 5, 7-
tetraphenyl-1, 5-diaza-3, 7-diphosphacyclooctane) with a variety of acids to form hydrogen …

Aggregation and weak gel formation by pectic polysaccharide homogalacturonan

PM Pieczywek, J Cieśla, W Płaziński, A Zdunek - Carbohydrate Polymers, 2021 - Elsevier
This study presents a novel model of homogalacturonan (HG) based on the dissipative
particle dynamics (DPD). The model was applied to investigate the mechanism of self …

On the rationalization of formation of solvates: Experimental and computational study of solid forms of several nitrobenzoic acid derivatives

A Berzins, A Kons, K Sarsuns, S Belyakov… - Crystal Growth & …, 2020 - ACS Publications
Analysis of crystal structures, molecular properties, interaction strength in solution, and
computationally generated nonsolvated form crystal structure landscapes of five …

[PDF][PDF] Unveiling the self-association and desolvation in crystal nucleation

D Li, Y Wang, S Zong, N Wang, X Li, Y Dong, T Wang… - IUCrJ, 2021 - journals.iucr.org
As the first step in the crystallization process, nucleation has been studied by many
researchers. In this work, phenacetin (PHEN) was selected as a model compound to …