From solution to thin film: molecular assembly of π-conjugated systems and impact on (opto) electronic properties

A Khasbaatar, Z Xu, JH Lee… - Chemical …, 2023 - ACS Publications
The assembly of conjugated organic molecules from solution to solid-state plays a critical
role in determining the thin film morphology and optoelectronic properties of solution …

One-pot cocrystallization of 1D linear and zigzag cobalt (II) polymers assembled by triclopyr and 4, 4′-bipyridine: Structural comparison, conformational analysis, non …

JX Li, MY Liu, X You, JQ Wang, X Feng - Polyhedron, 2024 - Elsevier
A pair of cobalt (II) compounds with formulas of [Co (3, 5, 6-tcpa) 2 (4, 4′-bipy)(EtOH)] n
(1A) and [Co (3, 5, 6-tcpa) 2 (4, 4′-bipy)(EtOH) 2] n (1B), have been cosynthesized through …

Confinement and Separation of Benzene from an Azeotropic Mixture Using a Chlorinated B← N Adduct

IJ Jupiter, JD Loya, N Lutz, PM Sittinger… - Crystal Growth & …, 2024 - ACS Publications
Separations of azeotropic mixtures are typically carried out using energy-demanding
processes (eg, distillation). Here, we report the capacity of a self-assembled chlorinated …

Engineering Lipophilic Aggregation of Adapalene and Adamantane-Based Cocrystals via van der Waals Forces and Hydrogen Bonding

J Bicknell, SA Agarwal, KJ Petersen… - Crystal Growth & …, 2024 - ACS Publications
Lipophilic aggregation using adamantanes is a widely exploited molecular property in
medicinal and materials chemistry. Adamantanes are traditionally installed to molecular …

Additive-Assisted Crystallization of 9, 10-Diphenylanthracene

AA Sonina, DS Cheshkina, MS Kazantsev - Crystals, 2023 - mdpi.com
Crystallization control of organic conjugated small molecules is in high demand for the
engineering of functional materials in organic optoelectronics. Here, we report solution …

Self-Assembled Supramolecular Frameworks and Interaction Energy Studies of Acridine and Dihydroxynaphthalene Based Cocrystals

R Jagan - Journal of Structural Chemistry, 2024 - Springer
Three cocrystals of acridine with 2, 7-dihydroxynaphthalene (Ia and Ib) in two different
polymorphs and 1, 5-dihydroxynaphthalene (II) have been synthesized and characterized by …

Predicting the excited-state properties of crystalline organic semiconductors using GW+ BSE and machine learning

S Gao, Y Luo, X Liu, N Marom - 2024 - chemrxiv.org
Excited-state properties of crystalline organic semiconductors are key to organic electronic
device applications. Machine learning (ML) models capable of predicting these properties …

One-pot cocrystallization of two different 1D cobalt (II) complexes with flexible triclopyr and 4, 4'-bipyridine synthons: structural comparison, conformation analyses …

JX Li, Y Lu, X Xu, C Liu, X Feng - Conformation Analyses, Non-Covalent … - papers.ssrn.com
A pair of cobalt (II) compounds with formulas of [Co (3, 5, 6-tcpa) 2 (4, 4'-bipy)(EtOH)] n (1A)
and [Co (3, 5, 6-tcpa) 2 (4, 4'-bipy)(EtOH) 2] n (1B), have been cosynthesized through the …

[HTML][HTML] 2021 JCP Emerging Investigator Special Collection

M Ceriotti, L Jensen, DE Manolopoulos… - The Journal of …, 2023 - pubs.aip.org
The Journal of Chemical Physics Emerging Investigator Special Collection and Best Paper
Award were first launched in 2019 to recognize the achievements of early career …