Anisotropic Dissymmetry Factor, g: Theoretical Investigation on Single Molecule Chiroptical Spectroscopy

M Wakabayashi, S Yokojima… - The Journal of …, 2014 - ACS Publications
A formula for an anisotropic dissymmetry factor g evaluating the chiroptical response of
orientationally fixed molecules is derived. Incorporating zeroth-and first-order multipole …

CO2 sequestration and recovery of high-purity CaCO3 from bottom ash of masson pine combustion using a multifunctional reagent—Amino acid

L Ji, X Zheng, Y Ren, Y Wang, Y Wang… - Separation and Purification …, 2024 - Elsevier
The indirect pH-swing process is a potential approach to achieving a waste-to-resource
supply chain by integrating mineral carbonation, element recovery, and valuable material …

Fate of Ca2+ and metal impurities of a typical coal fly ash in amino acid mediated CO2 mineralization and simultaneous CaCO3 recovery

Y Wang, X Zheng, Y Wang, S Lu, Z Fei, J Li, L Ji… - Separation and …, 2025 - Elsevier
CO 2 mineralization is a promising technology to achieve a waste-to-resource chain by
integrating CO 2 sequestration and alkaline solid waste utilization. Amino acids as a …

First principal studies of spectroscopic (IR and Raman, UV–visible), molecular structure, linear and nonlinear optical properties of l-arginine p-nitrobenzoate …

M Shkir, S AlFaify, H Abbas, S Muhammad - Spectrochimica Acta Part A …, 2015 - Elsevier
In current work, the authors have been applied the density functional theory (DFT) using
B3LYP and CAM-B3LYP exchange–correlation functional with 6-31G∗ basis set on l …

A severe acute pancreatitis mouse model transited from mild symptoms induced by a “two-hit” strategy with L-arginine

J Yang, X Tang, Q Wu, P Ren, Y Yan - Life, 2022 - mdpi.com
To develop a severe acute pancreatitis (SAP) model transited from mild symptoms, we
investigated a “two-hit” strategy with L-arginine in mice. The mice were intraperitoneally …

Benchmarking computational methods and influence of guest conformation on chirogenesis in zinc porphyrin complexes

I Osadchuk, V Borovkov, R Aav, E Clot - Physical Chemistry Chemical …, 2020 - pubs.rsc.org
Circular dichroism (CD) is a convenient and widely used tool for investigating structures of
chiral molecules. However, the unambiguous simulation of CD spectra is not a trivial task …

A novel L-arginine salt nonlinear optical crystal: L-arginine p-nitrobenzoate monohydrate (LANB)

L Wang, GH Zhang, XT Liu, LN Wang, XQ Wang… - Journal of Molecular …, 2014 - Elsevier
A novel l-arginine salt nonlinear optical single crystal, l-arginine p-nitrobenzoate
monohydrate (LANB) has been grown by slow cooling method from aqueous solution. Its …

Crystal structure, spectroscopic investigation and thermal properties of l-lysine p-toluenesulfonate

L Wang, DH Wang, GH Zhang, D Xu… - Journal of Molecular …, 2016 - Elsevier
A novel organic crystal was prepared from l-lysine (Lly) and p-toluenesulfonic acid (pTS),
which was grown from an aqueous solution by slow cooling method. The crystal system and …

Single crystal structure, hydrogen bonding interaction, charge transfer and thermal properties of a new guanidine derivative crystal: Phosphate bis-guanidinoacetate

L Wang, M **ao, D Wang - Journal of Molecular Structure, 2019 - Elsevier
In order to understand deeply the interaction between guanidine and phosphate groups in
crystal, phosphate bis-guanidinoacetate (PBGA) crystal was synthesized and grown by …

Anisotropic elliptical dichroism and influence of imperfection of circular polarization upon anisotropic circular dichroism

M Wakabayashi, S Yokojima, T Fukaminato… - The Journal of …, 2015 - pubs.aip.org
In spite of the importance of anisotropic circular dichroism, in practice, it is difficult to get rid
of the artifacts that arise from the imperfection of the circular polarization. Undesirable linear …