Results 221 to 230 of about 697,957 (318)

Activation of N₂O, CO₂, and CO at a sterically protected phosphorus center.

Dalton Trans
Wenger JS, Rowe WJ, Mehta M.
europepmc   +1 more source

Visualizing and teaching crystallographic symmetry using Jmol. [PDF]

Acta Crystallogr C Struct Chem
Johnston DH, Hanson RM.
europepmc   +1 more source

Ion-Atom Collisions: A Time-Dependent Density-Functional-Theory Perspective

, 2017
Matthew Baxter
openalex   +1 more source

Karl Popper and the Mechanisms of Hydrogen Embrittlement

Advanced Engineering Materials, EarlyView.
Representation of the beginning of loss of ductility rather than embrittlement. Small concentrations of hydrogen in a diffusible form within iron are well‐established to harm the mechanical integrity of steels. There are theories that attempt to explain the pernicious role of hydrogen.
H. K. D. H. Bhadeshia
wiley   +1 more source

DFT Calculations of Structure and IR Spectra of Gd₂@C₈₂ Endofullerenes. [PDF]

Molecules
Nechaev IV, Krisilov AV, Chernov VE, Holyavka MG.   +3 more
europepmc   +1 more source

Atomism, Anti-representationalism and a Sketch of an Alternative. Technical Report 2001-02

, 2001
Andrew Brook
openalex   +1 more source

The DFT+U dilemma in single-atom catalyst modeling: erroneous spin states and d-orbital localization

Shiyu He
openalex   +1 more source

Affecting the Properties of Copper–Graphene Electroconductive Composite by Severe Plastic Deformation

Advanced Engineering Materials, EarlyView.
Copper‐based composites enhanced with carbon feature convenient mechanical properties and favorable electric conductivity. Processing via deformation and thermomechanical treatments can introduce advantageous microstructures further enhancing their performance. Herein, copper–graphene powder‐based composites are directly consolidated via rotary swaging
Radim Kocich, Lenka Kunčická, Pavel Czernek, Zifan Wang   +3 more
wiley   +1 more source

Incommensurate structure of AlPO₄-5 and its stability. [PDF]

Acta Crystallogr B Struct Sci Cryst Eng Mater
Komatsu K, Ikeda T, Kodaira T.
europepmc   +1 more source

Multipoint Energetic Neutral Atom Studies with Polar, Geotail, and Tiros

, 2001
H. E. Spence
openalex   +1 more source