Chemical bonding in crystals: new directions

C Gatti - Zeitschrift für Kristallographie-Crystalline Materials, 2005 - degruyter.com
Abstract Analysis of the chemical bonding in the position space, instead of or besides that in
the wave function (Hilbert) orbital space, has become increasingly popular for crystalline …

Quantum crystallography: Current developments and future perspectives

A Genoni, L Bučinský, N Claiser… - … A European Journal, 2018 - Wiley Online Library
Crystallography and quantum mechanics have always been tightly connected because
reliable quantum mechanical models are needed to determine crystal structures. Due to this …

[HTML][HTML] ab initio description of bonding for transmission electron microscopy

J Madsen, TJ Pennycook, T Susi - Ultramicroscopy, 2021 - Elsevier
The simulation of transmission electron microscopy (TEM) images or diffraction patterns is
often required to interpret their contrast and extract specimen features. This is especially true …

First experimental characterization of a non-nuclear attractor in a dimeric magnesium (I) compound

JA Platts, J Overgaard, C Jones… - The Journal of …, 2011 - ACS Publications
High-resolution X-ray diffraction data, coupled with theoretical calculations, are used to
demonstrate the presence of a non-nuclear local maximum in the electron density of a …

The crystallography of aluminum and its alloys

PNH Nakashima - Encyclopedia of Aluminum and Its Alloys, Two …, 2018 - taylorfrancis.com
This article begins with pure aluminum and a discussion of the form of the crystal structure
and different unit cells that can be used to describe it. Measurements of the face-centered …

Heteronuclear and homonuclear bimetallic metallocenes of alkaline earths and zinc

MA Gosch, DJD Wilson - Organometallics, 2023 - ACS Publications
Hetero-and homonuclear dimetallocenes of group 2 (alkaline earth) and zinc metals,
CpMM′ Cp (M= Be, Mg, Ca, Sr, Ba, Zn), have been systematically investigated using …

[图书][B] Encyclopedia of aluminum and its alloys, two-volume set (print)

GE Totten, M Tiryakioglu, O Kessler - 2018 - taylorfrancis.com
This encyclopedia, written by authoritative experts under the guidance of an international
panel of key researchers from academia, national laboratories, and industry, is a …

NHC‐Stabilized Dialanes(4) of Al2Mes4

L Werner, J Hagn, U Radius - Chemistry–A European Journal, 2023 - Wiley Online Library
The synthesis and characterization of novel N‐heterocyclic carbene (NHC) stabilized
dialanes Al2Mes4 as well as first investigations concerning the reactivity of these …

Quantitative convergent-beam electron diffraction and quantum crystallography—the metallic bond in aluminium

PNH Nakashima - Structural Chemistry, 2017 - Springer
The technique of quantitative convergent-beam electron diffraction (QCBED) is reviewed as
a method for making very accurate and precise measurements of low-order bonding …

Well‐Defined Molecular Magnesium Hydride Clusters: Relationship between Size and Hydrogen‐Elimination Temperature

J Intemann, J Spielmann, P Sirsch… - Chemistry–A European …, 2013 - Wiley Online Library
A new tetranuclear magnesium hydride cluster,[{NN‐(MgH) 2} 2], which was based on a N
N‐coupled bis‐β‐diketiminate ligand (NN2−), was obtained from the reaction of [{NN …