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List of Figures
1.1
Chemical structure of the simplest porphyrin, Porphin
2.1
Schematic of the Auger process
2.2
Auger spectrum of a Mo sample contaminated by O and C
2.3
Auger electron spectroscopy apparatus.
2.4
Diagram of Bragg diffraction
2.5
The Ewald sphere construction
2.6
Experimental apparatus for low energy electron diffraction, LEED pattern recorded from the clean Mo(110) surface
2.7
Schematic of tunneling through a potential barrier
2.8
Diagram illustrating the difference between the constant current and constant height modes
2.9
Photograph of the Createc LT-STM system
2.10
Photograph of the Omicron VT-STM system
2.11
A model XAS spectrum
2.12
Schematic diagram showing the designation of XAS transitions according to their core energy level
2.13
Comparison of the 3s and 3p all-electron wavefunctions and pseudo-wavefunctions calculated for Si
2.14
Illustration of the Dirac step function and smearing
3.1
Room temperature STM of C
60
monolayer domains on the Au(111) surface
3.2
Schematic of the 7
×
7 R14
∘
superstructure of C
60
on Au(111)
3.3
C
60
trilayer on Ag/Si(111)-
×
R30
∘
with schematic of dimer and trimer formation
3.4
STM of C
60
trilayer showing single-molecular writing, erasing and rewriting
3.5
Diagram of the high-symmetry orientations of C
60
3.6
STM image and LEED of the WO
2
/W(110) surface
3.7
Top and side view of the WO
2
/W(110) surface
3.8
Low-temperature STM images acquired after the deposition of various coverages of C
60
molecules onto the WO
2
/W(110) surface
3.9
STM image of the closed C
60
monolayer on WO
2
/W(110)
3.10
STM image of C
60
on the WO
2
/W(110) surface, showing chains of the ‘dim’ molecules
3.11
Low-temperature STM image of C
60
on the WO
2
/W(110) surface showing orbital ordering
3.12
STM images of the C
60
monolayer showing the different cooling regimes and temperature-dependant behaviour
3.13
Squared probability of finding a static C
60
molecule,
p
2
, versus temperature,
T
.
3.14
Dynamics of the transitions between different molecular states of a C
60
monolayer at
T
= 256
K.
3.15
STM image demonstrating the decoration of the WO
2
rows of the underlying substrate surface by dim C
60
molecules and chains of spinning molecules
3.16
Model showing possible absorption sites on WO
2
/W(110)
3.17
Partial charge density simulations of static and composite images of spinning molecules
3.18
STM images of individual spinning molecules with a dip or a protrusion at the centre
3.19
STM images of the same area of the C
60
monolayer showing a molecule switching between different states
3.20
STM showing that very bright molecules are predominantly located along the top of the oxide nanorows
3.21
STM image showing the h–p orientation of very bright C
60
molecules
3.22
The time-evolution of the STM tip-surface distance above a switching C
60
molecule
3.23
The calculated density of states (DOS) for C
60
−
and C
60
on the WO
2
/W(110) surface
3.24
The apparent height difference Δ
Z
between the C
60
−
and the C
60
molecules
3.25
Cross sections of the Fukui functions
f
+
(
r
) and
f
−
(
r
) along the h–h and h–p bonds
4.1
STM of increasing NiP coverages on Ag(111)
4.2
STM of approximately 1.8 ML coverage of NiP on Ag(111), showing single-molecular missing rows
4.3
STM of 1 ML of NiTPP-dimers on the Ag(111) surface
4.4
Schematic models of the silver body-centred cubic structure and Ag(111) surface
4.5
Top and side-view model of the Ag/Si(111)-
×
R30
∘
surface
4.6
Molecular model of (5,15-diphenylporphyrinato)Ni(II)
4.7
STM images taken from 1 ML of the NiDPP on the Ag(111) surface, and NiDPP overlayer model
4.8
STM images taken from 1 ML of the NiDPP on the Ag(111) surface showing alignment with the step-edges
4.9
LEED pattern and 2D-FFT taken from NiDPP on the Ag(111) surface
4.10
STM image taken from 1 ML of the NiDPP on the Ag/Si(111)-
×
R30
∘
surface showing the three domains
4.11
Comparison of LEED and 2D-FFT of NiDPP on Ag/Si(111)-
×
R30
∘
5.1
Symbolic structural and ball-and-stick models of MnClTPP
5.2
Model and liquid-cell STM images of Mn1 molecule on Au(111) grown on mica
5.3
STM image of the Mn1 monolayer after a large proportion of the molecules have been oxidised, and histograms comparing statistical models
5.4
STM images from
∼
0.15
ML of MnClTPP and a monolayer island showing the chirality within the molecular overlayer
5.5
Relaxed models of MnClTPP on Ag(111) and comparison with STM, showing packing and buckling in the monolayer
5.6
STM images of 1 ML of MnClTPP showing the Cl-ligand at positive bias
5.7
Mn 2p XAS spectra acquired during the anneal and oxygen exposure of the Mn(III)ClTPP monolayer
5.8
STM images of 1 ML of MnTPP after annealing
5.9
Relaxed models calculated for Mn(III)ClTPP and Mn(III)TPP on Ag(111)
5.10
Cl 2p XPS taken while annealing the MnClTPP molecules at varying temperatures, and Arrhenius plot derived from the XPS intensities
5.11
STM images of 1 ML Mn(IV)O
2
TPP after various oxygen exposures
5.12
Relaxed model of the MnO
2
TPP after oxidation
5.13
O 1s XPS taken during the anneal of the Mn(IV)O
2
TPP ML and accompanying Arrhenius plot
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