Regularized weighted sine least-squares spectral analysis for gas electron diffraction data

DS Tikhonov - The Journal of Chemical Physics, 2023 - pubs.aip.org
Here, we present a new approach for obtaining radial distribution functions (RDF) from the
electron diffraction data using a regularized weighted sine least-squares spectral analysis. It …

Equilibrium molecular structure and intramolecular interactions of picolinic acid hydrazide

IN Kolesnikova, NA Chegodaev, PY Sharanov… - Chemical Physics …, 2022 - Elsevier
Conformational composition and molecule structure of gaseous picolinic acid hydrazide
(picolinohydrazide) have been investigated for the first time by means of joint application of …

[BOOK][B] Equilibrium Structure of Free Molecules: Theory, Experiment, and Data Analysis

N Vogt, J Demaison - 2023 - books.google.com
The properties of chemical, pharmaceutical, and biological compounds depend mainly on
their molecular structure, whose determination is of fundamental interest. This book …

Database with Equilibrium Structures of Free Molecules

N Vogt, J Demaison - Equilibrium Structure of Free Molecules: Theory …, 2023 - Springer
Equilibrium structures of free molecules determined by experimental methods and published
after 2017 are systematized. The presentation of structural datasets is similar to that in the …

Equilibrium Structure of Free Molecules

N Vogt, J Demaison - Springer
A considerable amount of work in chemistry has been devoted to the determination and
explanation of molecular structures and its resulting application to the dynamics of …