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Foreword | p. ix |
Periodic Fullerenes by Coalescence Reactions | p. 1 |
Fullerene Fusion via Stone-Wales Transformation | p. 1 |
Fullerene Dimers and Their Derivatives | p. 1 |
Theoretical Considerations About Fullerene Fusion | p. 5 |
Coalescence in Peapods | p. 8 |
Results and Discussion | p. 9 |
The sp2+3 Adducts: C120, C120 O and C120 O2 | p. 10 |
Coalescence by Stone-Wales Bond Flipping | p. 12 |
Pathway to C114 Tubulene | p. 16 |
Closed Nanotubes Viewed as Coalescence Products | p. 19 |
Finite-Length Carbon Nanotubes Related to C60 | p. 19 |
Simple Huckel Theory | p. 21 |
Leapfrog Transformation and Leapfrog Structures | p. 22 |
Construction and Classification of Nanotube Caps | p. 22 |
Armchair and Zig-Zag Closed Nanotubes | p. 23 |
Construction of Nanotube Caps | p. 23 |
Construction of Capped Armchair Nanotubes | p. 25 |
Construction of Capped Zig-Zag Nanotubes | p. 26 |
Energetics of Capped Nanotubes | p. 28 |
Methods | p. 28 |
Stability of Capped Armchair Nanotubes | p. 28 |
Stability of Capped Zig-Zag Nanotubes | p. 31 |
Conclusions | p. 33 |
References | p. 33 |
Polyhex Tori | p. 35 |
Introduction | p. 35 |
Construction of Polyhex Tori from Square Tiled Tori | p. 36 |
Topology of Polyhex Tori | p. 39 |
Strain Energy Calculation | p. 41 |
¿ Electronic Structure of Polyhex Tori | p. 43 |
Identical Polyhex Toroidal Graphs | p. 45 |
Resonance Energy in Polyhex Tori | p. 46 |
Conclusions | p. 47 |
References | p. 48 |
New Classes of Toroidal Structures | p. 51 |
Distinct Walled Tori | p. 51 |
DWNT as DWT Precursors | p. 51 |
Perfect Clar DWTs | p. 57 |
Conetori | p. 60 |
Conetori with: Internal H/Z-Tube, External V/A-Tube | p. 61 |
Conetori with: Internal H/Z-Tube, External Cone (Without Tube) | p. 63 |
Conetori with: Internal V/A-Tube, External Cone (Without Tube) | p. 64 |
Diameter Doubling of SWNT | p. 65 |
Conclusions | p. 67 |
References | p. 67 |
Counting Polynomials of Nanostructures | p. 69 |
Graph Theory Background | p. 69 |
Counting Polynomials | p. 77 |
Layer/Shell Matrices and Polynomial Coefficients | p. 78 |
Cluj Polynomials | p. 82 |
Properties of the Cluj Polynomials | p. 83 |
Omega-type Polynomials | p. 86 |
Hosoya Polynomial in Toroidal Nanostructures | p. 89 |
Polyhex (6,3) Covering | p. 89 |
Twisted T (6,3)HVt[c,n] Tori | p. 92 |
Covering ((4,8)3)S | p. 94 |
Omega Polynomial in Tubular Nanostructures | p. 98 |
Polyhex (6,3) Covering | p. 98 |
Covering ((4,8)3) | p. 104 |
QSPR Studies by Omega-derived Descriptors | p. 107 |
Conclusions | p. 111 |
References | p. 112 |
Operations on Maps | p. 115 |
Introduction | p. 115 |
Simple Operations on Maps | p. 116 |
Dualization Du | p. 116 |
Medial Me | p. 116 |
Truncation Tr | p. 117 |
Polygonal Pn Capping | p. 117 |
Snub Sn | p. 118 |
Composite Operations | p. 119 |
Leapfrog Le | p. 119 |
Quadrupling Q | p. 120 |
Septupling Operations | p. 121 |
Molecular Realization of Septupling Operations | p. 126 |
Generalized Operations | p. 128 |
Isomerization Routes on Tubular Nanostructures | p. 130 |
Isomerizations on (6,3) Net | p. 132 |
Isomerizations on ((4,8) Net | p. 133 |
Conclusions | p. 135 |
References | p. 135 |
Aromaticity of Nanostructures | p. 137 |
Introduction | p. 137 |
Aromaticity of Nanostructures | p. 138 |
Corannulenic Cages | p. 140 |
Coraznulenic Cages | p. 145 |
Covering by [n: (7(5c))n] Fw Patterns | p. 146 |
Covering by [n: (7(5d))n] Fw, 3 | p. 149 |
Retro Endo-Kroto Reaction | p. 161 |
Conclusions | p. 163 |
References | p. 163 |
Triply Periodic Nanostructures | p. 167 |
Introduction | p. 167 |
Background on Surface Curvature | p. 168 |
Carbon Lattices Embedded in TPMSs | p. 170 |
Nanotube Junctions | p. 172 |
Digonal Junctions | p. 173 |
Planar Junctions | p. 173 |
Tetrahedral Junctions | p. 175 |
Octahedral Junctions | p. 177 |
Icosahedral Junctions | p. 178 |
Structures of High Genera | p. 179 |
Periodic Schwarzites | p. 180 |
D-and FRD-Type Schwarzites | p. 180 |
P-Type Schwarzites | p. 187 |
Conclusions | p. 188 |
References | p. 189 |
Gallery of Carbon Nano Junctions and Derived Infinite Lattices | p. 193 |
Index | p. 205 |
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