A New Computational Interface for Catalysis

10.26434/chemrxiv.8040737.v4 ◽

2019 ◽

Author(s):

Pavlo Kravchenko ◽

Craig Plaisance ◽

David Hibbitts

Keyword(s):

Zeolite Catalyst ◽

Metal Ceramic ◽

Catalyst Systems ◽

Computational Catalysis

This manuscript outlines the utility and power of our computational catalysis interface. This interface has been developed by our group and used extensively to study metal, ceramic, and zeolite catalyst systems.

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A New Computational Interface for Catalysis

10.26434/chemrxiv.8040737.v3 ◽

2019 ◽

Cited By ~ 2

Author(s):

Pavlo Kravchenko ◽

Craig Plaisance ◽

David Hibbitts

Keyword(s):

Zeolite Catalyst ◽

Metal Ceramic ◽

Catalyst Systems ◽

Computational Catalysis

This manuscript outlines the utility and power of our computational catalysis interface. This interface has been developed by our group and used extensively to study metal, ceramic, and zeolite catalyst systems.

Get full-text (via PubEx)

A New Computational Interface for Catalysis

10.26434/chemrxiv.8040737.v2 ◽

2019 ◽

Author(s):

Pavlo Kravchenko ◽

Craig Plaisance ◽

David Hibbitts

Keyword(s):

Zeolite Catalyst ◽

Metal Ceramic ◽

Catalyst Systems ◽

Computational Catalysis

This manuscript outlines the utility and power of our computational catalysis interface. This interface has been developed by our group and used extensively to study metal, ceramic, and zeolite catalyst systems.

Get full-text (via PubEx)

A New Computational Interface for Catalysis

10.26434/chemrxiv.8040737.v1 ◽

2019 ◽

Author(s):

Pavlo Kravchenko ◽

Craig Plaisance ◽

David Hibbitts

Keyword(s):

Zeolite Catalyst ◽

Metal Ceramic ◽

Catalyst Systems ◽

Computational Catalysis

This manuscript outlines the utility and power of our computational catalysis interface. This interface has been developed by our group and used extensively to study metal, ceramic, and zeolite catalyst systems.

Get full-text (via PubEx)

Zeolite catalyst systems

Zeolites ◽

10.1016/0144-2449(96)86029-5 ◽

1996 ◽

Vol 16 (1) ◽

pp. 80

Keyword(s):

Zeolite Catalyst ◽

Catalyst Systems

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Development and application of 3-dimensional transmission electron microscopy (3D-TEM) for the characterization of metal-zeolite catalyst systems

Studies in Surface Science and Catalysis - 12th International Congress on Catalysis, Proceedings of the 12th ICC ◽

10.1016/s0167-2991(00)80978-7 ◽

2000 ◽

pp. 329-334 ◽

Cited By ~ 24

Author(s):

A.J. Koster ◽

U. Ziese ◽

A.J. Verkleij ◽

A.H. Janssen ◽

J. de Graaf ◽

...

Keyword(s):

Electron Microscopy ◽

Transmission Electron Microscopy ◽

Zeolite Catalyst ◽

3 Dimensional ◽

Transmission Electron ◽

Catalyst Systems

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Analytical and High-Resolution EM Study of Crystalline Phases formed at Metal-Ceramic Interface

Proceedings, annual meeting, Electron Microscopy Society of America ◽

10.1017/s0424820100135733 ◽

1990 ◽

Vol 48 (2) ◽

pp. 426-427

Author(s):

N. Merk ◽

A. P. Tomsia ◽

G. Thomas

Keyword(s):

Cross Section ◽

Dissimilar Materials ◽

Ceramic Materials ◽

Electron Micrograph ◽

Scanning Electron Micrograph ◽

Structural Applications ◽

Metal Ceramic ◽

The Subject ◽

Ceramic Compounds ◽

Scanning Electron

A recent development of new ceramic materials for structural applications involves the joining of ceramic compounds to metals. Due to the wetting problem, an interlayer material (brazing alloy) is generally used to achieve the bonding. The nature of the interfaces between such dissimilar materials is the subject of intensive studies and is of utmost importance to obtain a controlled microstructure at the discontinuities to satisfy the demanding properties for engineering applications . The brazing alloy is generally ductile and hence, does not readily fracture. It must also wett the ceramic with similar thermal expansion coefficient to avoid large stresses at joints. In the present work we study mullite-molybdenum composites using a brazing alloy for the weldment.A scanning electron micrograph from the cross section of the joining sequence studied here is presented in Fig. 1.

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