Computer modelling of microporous materials:
Gespeichert in:
| Format: | Elektronisch E-Book |
|---|---|
| Sprache: | English |
| Veröffentlicht: |
Amsterdam
Elsevier
2004
|
| Ausgabe: | 1st ed |
| Schlagworte: | |
| Online-Zugang: | Volltext |
| Beschreibung: | Title from e-book title screen (viewed Nov. 15, 2007) Includes bibliographical references and index Microporous materials, including both zeolites and aluminophosphates are amongst the most fascinating classes of materials, with wide ranging important applications in catalysis, gas separation and ion exchange. The breadth of the field has, moreover, been extended in the last ten years by the discovery of the versatile and exciting ranges of mesoporous materials. Computational methods have a long and successful history of application in solid state and materials science, where they are indeed established tools in modelling structural and dynamic properties of the bulk and surfaces of solids; and where they are playing an increasingly important role in understanding reactivity. Their application to zeolite science developed strongly in the 1980's, with the initial successes in modelling structure and sorption, and with emerging capability in quantum mechanical methods. The field was reviewed over ten years, since then there have been major developments in techniques and of course the power of the available hardware, which have promoted a whole range of new applications to real complex problems in the science of microporous materials. This book aims to summarise and illustrate the current capabilities of atomistic computer modelling methods in this growing field. - Details advances in the rapidly expanding field of microporous materials. - Summarises key current techniques in this type of modelling. - Illustrates the current capabilities of atomistic computer modelling methods |
| Beschreibung: | 1 Online-Ressource (viii, 287 pages) |
| ISBN: | 008047229X 9780080472294 9780121641375 0121641376 |
Internformat
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| 500 | |a Title from e-book title screen (viewed Nov. 15, 2007) | ||
| 500 | |a Includes bibliographical references and index | ||
| 500 | |a Microporous materials, including both zeolites and aluminophosphates are amongst the most fascinating classes of materials, with wide ranging important applications in catalysis, gas separation and ion exchange. The breadth of the field has, moreover, been extended in the last ten years by the discovery of the versatile and exciting ranges of mesoporous materials. Computational methods have a long and successful history of application in solid state and materials science, where they are indeed established tools in modelling structural and dynamic properties of the bulk and surfaces of solids; and where they are playing an increasingly important role in understanding reactivity. Their application to zeolite science developed strongly in the 1980's, with the initial successes in modelling structure and sorption, and with emerging capability in quantum mechanical methods. The field was reviewed over ten years, since then there have been major developments in techniques and of course the power of the available hardware, which have promoted a whole range of new applications to real complex problems in the science of microporous materials. This book aims to summarise and illustrate the current capabilities of atomistic computer modelling methods in this growing field. - Details advances in the rapidly expanding field of microporous materials. - Summarises key current techniques in this type of modelling. - Illustrates the current capabilities of atomistic computer modelling methods | ||
| 650 | 4 | |a Matériaux poreux | |
| 650 | 7 | |a TECHNOLOGY & ENGINEERING / Material Science |2 bisacsh | |
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| 650 | 4 | |a Microstructure |x Computer simulation | |
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Datensatz im Suchindex
| _version_ | 1804152886339305472 |
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| building | Verbundindex |
| bvnumber | BV042304406 |
| classification_rvk | UG 2300 |
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| ctrlnum | (OCoLC)162571348 (DE-599)BVBBV042304406 |
| dewey-full | 620.1160113 |
| dewey-hundreds | 600 - Technology (Applied sciences) |
| dewey-ones | 620 - Engineering and allied operations |
| dewey-raw | 620.1160113 |
| dewey-search | 620.1160113 |
| dewey-sort | 3620.1160113 |
| dewey-tens | 620 - Engineering and allied operations |
| discipline | Physik |
| edition | 1st ed |
| format | Electronic eBook |
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| indexdate | 2024-07-10T01:17:50Z |
| institution | BVB |
| isbn | 008047229X 9780080472294 9780121641375 0121641376 |
| language | English |
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| spelling | Computer modelling of microporous materials edited by C.R.A. Catlow, R.A. van Santen, B. Smit 1st ed Amsterdam Elsevier 2004 1 Online-Ressource (viii, 287 pages) txt rdacontent c rdamedia cr rdacarrier Title from e-book title screen (viewed Nov. 15, 2007) Includes bibliographical references and index Microporous materials, including both zeolites and aluminophosphates are amongst the most fascinating classes of materials, with wide ranging important applications in catalysis, gas separation and ion exchange. The breadth of the field has, moreover, been extended in the last ten years by the discovery of the versatile and exciting ranges of mesoporous materials. Computational methods have a long and successful history of application in solid state and materials science, where they are indeed established tools in modelling structural and dynamic properties of the bulk and surfaces of solids; and where they are playing an increasingly important role in understanding reactivity. Their application to zeolite science developed strongly in the 1980's, with the initial successes in modelling structure and sorption, and with emerging capability in quantum mechanical methods. The field was reviewed over ten years, since then there have been major developments in techniques and of course the power of the available hardware, which have promoted a whole range of new applications to real complex problems in the science of microporous materials. This book aims to summarise and illustrate the current capabilities of atomistic computer modelling methods in this growing field. - Details advances in the rapidly expanding field of microporous materials. - Summarises key current techniques in this type of modelling. - Illustrates the current capabilities of atomistic computer modelling methods Matériaux poreux TECHNOLOGY & ENGINEERING / Material Science bisacsh Porous materials Computer simulation Microstructure Computer simulation Modellierung (DE-588)4170297-9 gnd rswk-swf Mikroporosität (DE-588)4604721-9 gnd rswk-swf Poröser Stoff (DE-588)4046811-2 gnd rswk-swf 1\p (DE-588)4143413-4 Aufsatzsammlung gnd-content Poröser Stoff (DE-588)4046811-2 s Mikroporosität (DE-588)4604721-9 s Modellierung (DE-588)4170297-9 s 2\p DE-604 Catlow, C. R. A. Sonstige oth Santen, R. A. van Sonstige oth Smit, B. J. Sonstige oth Erscheint auch als Druck-Ausgabe, Hardcover 0-12-164137-6 http://www.sciencedirect.com/science/book/9780121641375 Verlag Volltext 1\p cgwrk 20201028 DE-101 https://d-nb.info/provenance/plan#cgwrk 2\p cgwrk 20201028 DE-101 https://d-nb.info/provenance/plan#cgwrk |
| spellingShingle | Computer modelling of microporous materials Matériaux poreux TECHNOLOGY & ENGINEERING / Material Science bisacsh Porous materials Computer simulation Microstructure Computer simulation Modellierung (DE-588)4170297-9 gnd Mikroporosität (DE-588)4604721-9 gnd Poröser Stoff (DE-588)4046811-2 gnd |
| subject_GND | (DE-588)4170297-9 (DE-588)4604721-9 (DE-588)4046811-2 (DE-588)4143413-4 |
| title | Computer modelling of microporous materials |
| title_auth | Computer modelling of microporous materials |
| title_exact_search | Computer modelling of microporous materials |
| title_full | Computer modelling of microporous materials edited by C.R.A. Catlow, R.A. van Santen, B. Smit |
| title_fullStr | Computer modelling of microporous materials edited by C.R.A. Catlow, R.A. van Santen, B. Smit |
| title_full_unstemmed | Computer modelling of microporous materials edited by C.R.A. Catlow, R.A. van Santen, B. Smit |
| title_short | Computer modelling of microporous materials |
| title_sort | computer modelling of microporous materials |
| topic | Matériaux poreux TECHNOLOGY & ENGINEERING / Material Science bisacsh Porous materials Computer simulation Microstructure Computer simulation Modellierung (DE-588)4170297-9 gnd Mikroporosität (DE-588)4604721-9 gnd Poröser Stoff (DE-588)4046811-2 gnd |
| topic_facet | Matériaux poreux TECHNOLOGY & ENGINEERING / Material Science Porous materials Computer simulation Microstructure Computer simulation Modellierung Mikroporosität Poröser Stoff Aufsatzsammlung |
| url | http://www.sciencedirect.com/science/book/9780121641375 |
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