Vibrational self-consistent field calculations for spectroscopy of biological molecules: new algorithmic developments and applications

TK Roy, RB Gerber - Physical Chemistry Chemical Physics, 2013 - pubs.rsc.org
This review describes the vibrational self-consistent field (VSCF) method and its other
variants for computing anharmonic vibrational spectroscopy of biological molecules. The …

Microwave spectroscopy of biomolecular building blocks

JL Alonso, JC López - Gas-Phase IR Spectroscopy and Structure of …, 2015 - Springer
Microwave spectroscopy, considered as the most definitive gas phase structural probe, is
able to distinguish between different conformational structures of a molecule, because they …

The conformational behaviour of free D-glucose—at last

JL Alonso, MA Lozoya, I Pena, JC López… - Chemical …, 2014 - pubs.rsc.org
The conformational behaviour of isolated D-glucose has been revealed in this work using
Fourier transform microwave spectroscopy coupled with laser ablation of crystalline α-and β …

Eco-friendly and cost-effective synthesis of ZnO nanopowders by Tapioca-assisted sol-gel route

WL de Almeida, FS Rodembusch, NS Ferreira… - Ceramics …, 2020 - Elsevier
This study presents a low-cost method for obtaining nanometric zinc oxide (ZnO) using a
cassava starch (Tapioca)-assisted by sol-gel route. In this procedure, ZnO nanopowders …

Adsorption and reactivity of cellulosic aldoses on transition metals

QT Trinh, BK Chethana, SH Mushrif - The Journal of Physical …, 2015 - ACS Publications
The adsorption of cellulosic biomass derived aldoses on heterogeneous catalysts is the first
and governing step in their conversion to platform chemicals. However, there is a …

Mid-infrared photoacoustic spectroscopy using a quantum cascade laser for non-invasive blood component analysis

M Maeno, S Kino, Y Matsuura - Japanese Journal of Applied …, 2023 - iopscience.iop.org
We developed a photoacoustic spectroscopic method using mid-IR light for non-invasive
analysis of blood components in living bodies. The ultra-low-volume photoacoustic cell …

Vibrational spectra of α-glucose, β-glucose, and sucrose: anharmonic calculations and experiment

B Brauer, M Pincu, V Buch, I Bar… - The Journal of …, 2011 - ACS Publications
The anharmonic vibrational spectra of α-d-glucose, β-d-glucose, and sucrose are computed
by the vibrational self-consistent field (VSCF) method, using potential energy surfaces from …

Spectroscopic investigation of the impact of cold plasma treatment at atmospheric pressure on sucrose and glucose

A Hauswirth, R Köhler, L Ten Bosch, G Avramidis… - Foods, 2022 - mdpi.com
When exposing food and feedstuff to cold atmospheric pressure plasmas (CAPP), eg, for
decontamination purposes, possible unwanted effects on the contained nutrients might …

Mechanism and theory of d-glucopyranose homogeneous acid catalysis in the aqueous solution phase

MK Ghosh, MS Howard, K Dussan… - Physical Chemistry …, 2019 - pubs.rsc.org
A detailed systematic theoretical study of the mechanism of the homogeneous Brønsted-acid
catalysis of D-glucose in aqueous solution phase (“acid hydrolysis”) is reported. G4MP2 with …

[BOOK][B] Physics and chemistry at low temperatures

L Khriachtchev - 2019 - books.google.com
Tunneling reactions in chemistry are characterized by the low-temperature limit when the
classical contribution is negligible. Many practical applications benefit from the lack of heat …