Untersuchung der Assoziation und Reifung von BiO-Pränukelationsclustern:
Gespeichert in:
| 1. Verfasser: | |
|---|---|
| Format: | Abschlussarbeit Buch |
| Sprache: | German English |
| Veröffentlicht: |
Erlangen ; Nürnberg
[2018]
|
| Schlagworte: | |
| Online-Zugang: | Inhaltsverzeichnis Inhaltsverzeichnis |
| Beschreibung: | Enthält 3 Sonderdrucke |
| Beschreibung: | v, 140 Seiten, 31 verschieden gezählte Seiten Illustrationen, Diagramme 21 cm |
Internformat
MARC
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| 100 | 1 | |a Walther, Markus |e Verfasser |0 (DE-588)1197092919 |4 aut | |
| 245 | 1 | 0 | |a Untersuchung der Assoziation und Reifung von BiO-Pränukelationsclustern |c vorgelegt von Diplom-Chemiker (Univ.) Markus Walther |
| 264 | 1 | |a Erlangen ; Nürnberg |c [2018] | |
| 300 | |a v, 140 Seiten, 31 verschieden gezählte Seiten |b Illustrationen, Diagramme |c 21 cm | ||
| 336 | |b txt |2 rdacontent | ||
| 337 | |b n |2 rdamedia | ||
| 338 | |b nc |2 rdacarrier | ||
| 500 | |a Enthält 3 Sonderdrucke | ||
| 502 | |b Dissertation |c Friedrich-Alexander-Universität Erlangen-Nürnberg |d 2018 | ||
| 650 | 0 | 7 | |a Bismutoxide |0 (DE-588)4145739-0 |2 gnd |9 rswk-swf |
| 650 | 0 | 7 | |a Kristallisation |0 (DE-588)4033215-9 |2 gnd |9 rswk-swf |
| 650 | 0 | 7 | |a Nanopartikel |0 (DE-588)4333369-2 |2 gnd |9 rswk-swf |
| 650 | 0 | 7 | |a Polykristall |0 (DE-588)4188261-1 |2 gnd |9 rswk-swf |
| 655 | 7 | |0 (DE-588)4113937-9 |a Hochschulschrift |2 gnd-content | |
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| 999 | |a oai:aleph.bib-bvb.de:BVB01-031592079 | ||
Datensatz im Suchindex
| _version_ | 1804180608026411009 |
|---|---|
| adam_text | TABLE
OF
CONTENTS
TABLE
OF
CONTENTS
...................................................................................................
IN
1
MOTIVATION
1
2
CRYSTALS
AND
CRYSTAL
FORMATION
3
2.1
STATES
OF
SOLID
MATTER
..................................................................................
3
2.2
BASIC
KINETICS
AND
THERMODYNAMICS
OF
NUCLEATION
AND
CRYSTALLIZATION
.
5
2.3
CLASSICAL
NUCLEATION
THEORY
......................................................................
7
2.4
MULTI-STEP
NUCLEATION
..................................................................................
10
2.5
CRYSTALS
AND
CRYSTAL
POLYMORPHS
.................................................................
14
2.5.1
APPLICATIONS
OF
POLYMORPHISM
........................................................
15
2.6
STRATEGIES
FOR
ADVANCED
CRYSTAL
ENGINEERING
.............................................
22
2.7
METHODS
OF
INTROSPECTION
............................................................................
23
2.7.1
ULTRACENTRIFUGATION
.........................................................................
23
2.7.2
ESI-MS
.............................................................................................
23
2.7.3
X-RAY
DIFFRACTION
SPECTROSCOPY
........................................................
24
2.7.4
SIMULATION
.......................................................................................
26
BEFERENCES
..............................................................................................................
28
3
MOLECULAR
SIMULATION
30
3.1
CALCULATING
FORCES
AND
POTENTIALS
..............................................................
31
3.1.1
AB-INITIO
QUANTUM
MECHANICS
........................................................
32
3.1.2
DENSITY
FUNCTIONAL
THEORY
..............................................................
34
3.1.3
MOLECULAR
MECHANICS
......................................................................
35
3.2
MOVING
SIMULATED
ATOMS
............................................................................
37
3.2.1
SIMPLE
ENERGY
MINIMIZATION
...........................................................
37
3.2.2
MOLECULAR
DYNAMICS
.........................................................................
37
3.2.3
PERIODIC
BOUNDARY
CONDITIONS
........................................................
42
3.3
STATISTICAL
METHODS
.......................................................................................
43
3.3.1
KAWSKA-ZAHN
AGGREGATION
..............................................................
43
BEFERENCES
..............................................................................................................
45
4
THE
SYSTEM
BISMUTH
OXIDE
49
4.1
BISMUTH
........................................................................................................
49
4.2
BISMUTH
OXIDE
AND
ITS
POLYMORPHS
...........................................................
49
4.2.1
APPLICATIONS
OF
BISMUTH
OXIDE
........................................................
56
4.2.2
POLYMORPH-CONTROLLED
SYNTHESIS
OF
BISMUTH
OXIDE
.......................
56
III
IV
4.3
BISMUTH
OXIDE
NANOPARTICLES
AND
THE
MODEL
SYSTEM
BISSO^OH^NG^G
57
REFERENCES
..............................................................................................................
60
5
MOLECULAR
MECHANISMS
OF
[BI
6
O4(OH)
4
](NO
3
)6
PRECURSOR
ACTIVATION,
AG
GLOMERATION,
AND
RIPENING
TOWARDS
BISMUTH
OXIDE
NUCLEI
62
5.1
INTRODUCTION
...................................................................................................
63
5.2
RESULTS
AND
DISCUSSION
...............................................................................
63
5.3
CONCLUSION
......................................................................................................
68
5.4
SIMULATION
DETAILS
........................................................................................
68
5.5
ACKNOWLEDGMENTS
........................................................................................
69
REFERENCES
..............................................................................................................
69
6
INVESTIGATIONS
ON
THE
GROWTH
OF
BISMUTH
OXIDO
CLUSTERS
AND
THE
NUCLEATION
TO
GIVE
METASTABLE
BISMUTH
OXIDE
MODIFICATIONS
71
6.1
ABSTRACT
.........................................................................................................
71
6.2
INTRODUCTION
...................................................................................................
72
6.3
SYNTHESIS
AND
CHARACTERIZATION
OF
BISMUTH
OXIDO
CLUSTERS
.......................
73
6.3.1
INVESTIGATION
OF
THE
INFLUENCE
OF
LIGANDS
ON
THE
CRYSTAL
GROWTH
AND
STABILITY
OF
BISMUTH
OXIDO
CLUSTERS
................................................
73
6.3.2
ESI-MS
STUDIES
ON
THE
LIGAND
EXCHANGE
ON
POLYNUCLEAR
BISMUTH
OXIDO
CLUSTERS
AND
DUSTER
GROWTH
...................................................
81
6.3.3
INFLUENCE
OF
THE
PK
A
VALUE
OF
ADDITIVES
IN
THE
SYNTHESIS
OF
BISMUTH
OXIDEO
CLUSTERS
AND
BISMUTH(III)
OXIDES
........................................
85
6.3.4
INFLUENCE
OF
THE
LIGANDS
ON
THE
FORMATION
OF
BISMUTH(III)
OXIDES
87
6.4
ELUCIDATION
OF
NUCLEATION
PROCESSES
...........................................................
88
6.4.1
CHARACTERIZATION
OF
BISMUTH
OXIDO
CLUSTERS
AND
*
MAGIC
NUNBER
*
INTERMEDIATES
.....................................................................................
88
6.4.2
MOLECULAR
DYNAMICS
SIMULATIONS
ON
DUSTER
GROWTH
IN
SOLUTION
.
.
90
6.5
SYNTHESIS
AND
CHARACTERIZATION
OF
BISMUTH(III)
OXIDES
............................
92
6.5.1
HYDROLSIS
OF
POLYNUCLEAR
BISMUTH
OXIDO
CLUSTERS
..........................
94
6.5.2
THERMAL
DECOMPOSITION
OF
POLYNUCLEAR
BISMUTH
OXIDO
CLUSTERS
DE-
PENDING
ON
THE
LIGANDS,
DUSTER
SIZE
AND
STRUCTURAL
MOTIFS
....
96
6.5.3
CHARACTERIZATION
OF
THE
AMORPHOUS
MATERIAL
AS-OBTAINED
FROM
HY-
DROLYSIS
STUDIES
OF
BISMUTH
OXIDO
CLUSTERS
.....................................
98
6.5.4
MICROWAVE-ASSISTED
HYDROLYSIS
OF
POLYNUCLEAR
BISMUTH
OXIDO
CLUS
TERS
AND
THE
EFFECTS
OF
IMPURITIES
...................................................
101
6.5.5
REACTIVITY
OF
METASTABLE
SS-BI
2
O3
NANOPARTICLES
IN
SOLID
STATE
RE-
ACTIONS
................................................................................................
105
6.6
CONCLUSION
......................................................................................................
106
6.7
ACKNOWLEDGEMENTS
........................................................................................
110
REFERENCES
..............................................................................................................
111
7
FROM
BISMUTH
OXIDE/HYDROXIDE
PRECURSOR
CLUSTERS
TOWARDS
STABLE
OXIDES:
PROTON
TRANSFER
REACTIONS
AND
STRUCTURAL
REORGANIZATION
GOVERN
THE
STA-
BILITY
OF
[BII80I3(OH)IO]-NITRATE
CLUSTERS
117
7.1
ABSTRACT
........................................................................................................
117
7.2
INTRODUCTION
...................................................................................................
118
7.3
MODELS
AND
METHODS
.....................................................................................
119
7.4
RESULTS
...........................................................................................................
120
7.5
CONCLUSIONS
...................................................................................................
125
7.6
ACKNOWLEDGEMENTS
.......................................................................................
125
REFERENCES
..............................................................................................................
125
8
SUMMARY
128
9
CONCLUSION
AND
OUTLOOK
130
10
ZUSAMMENFASSUNG
134
11
ABSCHLUSS
UND
AUSBLICK
137
|
| any_adam_object | 1 |
| author | Walther, Markus |
| author_GND | (DE-588)1197092919 |
| author_facet | Walther, Markus |
| author_role | aut |
| author_sort | Walther, Markus |
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| building | Verbundindex |
| bvnumber | BV046213223 |
| ctrlnum | (OCoLC)1125190677 (DE-599)DNB1196903727 |
| discipline | Physik |
| format | Thesis Book |
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| id | DE-604.BV046213223 |
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| spelling | Walther, Markus Verfasser (DE-588)1197092919 aut Untersuchung der Assoziation und Reifung von BiO-Pränukelationsclustern vorgelegt von Diplom-Chemiker (Univ.) Markus Walther Erlangen ; Nürnberg [2018] v, 140 Seiten, 31 verschieden gezählte Seiten Illustrationen, Diagramme 21 cm txt rdacontent n rdamedia nc rdacarrier Enthält 3 Sonderdrucke Dissertation Friedrich-Alexander-Universität Erlangen-Nürnberg 2018 Bismutoxide (DE-588)4145739-0 gnd rswk-swf Kristallisation (DE-588)4033215-9 gnd rswk-swf Nanopartikel (DE-588)4333369-2 gnd rswk-swf Polykristall (DE-588)4188261-1 gnd rswk-swf (DE-588)4113937-9 Hochschulschrift gnd-content Bismutoxide (DE-588)4145739-0 s Kristallisation (DE-588)4033215-9 s Polykristall (DE-588)4188261-1 s Nanopartikel (DE-588)4333369-2 s DE-604 B:DE-101 application/pdf https://d-nb.info/1196903727/04 Inhaltsverzeichnis DNB Datenaustausch application/pdf http://bvbr.bib-bvb.de:8991/F?func=service&doc_library=BVB01&local_base=BVB01&doc_number=031592079&sequence=000001&line_number=0001&func_code=DB_RECORDS&service_type=MEDIA Inhaltsverzeichnis |
| spellingShingle | Walther, Markus Untersuchung der Assoziation und Reifung von BiO-Pränukelationsclustern Bismutoxide (DE-588)4145739-0 gnd Kristallisation (DE-588)4033215-9 gnd Nanopartikel (DE-588)4333369-2 gnd Polykristall (DE-588)4188261-1 gnd |
| subject_GND | (DE-588)4145739-0 (DE-588)4033215-9 (DE-588)4333369-2 (DE-588)4188261-1 (DE-588)4113937-9 |
| title | Untersuchung der Assoziation und Reifung von BiO-Pränukelationsclustern |
| title_auth | Untersuchung der Assoziation und Reifung von BiO-Pränukelationsclustern |
| title_exact_search | Untersuchung der Assoziation und Reifung von BiO-Pränukelationsclustern |
| title_full | Untersuchung der Assoziation und Reifung von BiO-Pränukelationsclustern vorgelegt von Diplom-Chemiker (Univ.) Markus Walther |
| title_fullStr | Untersuchung der Assoziation und Reifung von BiO-Pränukelationsclustern vorgelegt von Diplom-Chemiker (Univ.) Markus Walther |
| title_full_unstemmed | Untersuchung der Assoziation und Reifung von BiO-Pränukelationsclustern vorgelegt von Diplom-Chemiker (Univ.) Markus Walther |
| title_short | Untersuchung der Assoziation und Reifung von BiO-Pränukelationsclustern |
| title_sort | untersuchung der assoziation und reifung von bio pranukelationsclustern |
| topic | Bismutoxide (DE-588)4145739-0 gnd Kristallisation (DE-588)4033215-9 gnd Nanopartikel (DE-588)4333369-2 gnd Polykristall (DE-588)4188261-1 gnd |
| topic_facet | Bismutoxide Kristallisation Nanopartikel Polykristall Hochschulschrift |
| url | https://d-nb.info/1196903727/04 http://bvbr.bib-bvb.de:8991/F?func=service&doc_library=BVB01&local_base=BVB01&doc_number=031592079&sequence=000001&line_number=0001&func_code=DB_RECORDS&service_type=MEDIA |
| work_keys_str_mv | AT walthermarkus untersuchungderassoziationundreifungvonbiopranukelationsclustern |
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