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CONTENTS
CONTENTS
Materials Discovery
Materials Discovery
Isomeric approaches to new structures
Unconventional molecules
Transport through H-bonds (non-covalent nanobelts)
Noncovalent Nanobelts (NCNs)
Noncovalent Nanobelts (NCNs)
Isomers of Organic Semiconductors
Isomers of Organic Semiconductors
Isomeric Alternatives to Pentacene for TFTs
Isomeric Alternatives to Pentacene for TFTs
Synthesis of Thermally Stable Molecular Wires
Synthesis of Thermally Stable Molecular Wires
Materials Recovery
Materials Recovery
Gold halide recovery with cucubit[6]uril
Gold and silver cyanide complexation with cyclodextrin
Tellurium complexation from raw materials
Gold and Silver Cyanide Complexation with Cyclodextrin
Gold and Silver Cyanide Complexation with Cyclodextrin
Supramolecular Gold Stripping from Activated Carbon Using α-Cyclodextrin (in press)
Tellurium Complexation from Raw Materials
Tellurium Complexation from Raw Materials
Synthesis and Characterization of Tellurium-Catecholates and their N-Oxide Adducts (in press)
Functional Materials
Functional Materials
Single-molecule sensors
Spintronics of covalently functionalized MoS2 monolayers
Conductivity of Pt-Pt complexes
Small-molecule organic dielectrics
Optical transitions in metal nanoclusters
New electronic Stark effect in boron nanoflake junctions
Spintronics of Covalently Functionalized
Spintronics of Covalently Functionalized
2D MoS2 Monolayers
2D MoS2 Monolayers
Pt-Pt Transition Metal Complexes (TMCs)
Pt-Pt Transition Metal Complexes (TMCs)
Small-Molecule Organic Dielectrics
Small-Molecule Organic Dielectrics
New Electronic Stark Effect in Boron Nanoflake Junctions
New Electronic Stark Effect in Boron Nanoflake Junctions
Supramolecular Materials
Supramolecular Materials
IR-emissive organic co-crystals
Cyclic daisy chains
Ring-in-ring (s) complexes
IR-Emissive Organic Co-Crystals
IR-Emissive Organic Co-Crystals
Organic Photovoltaics
Organic Photovoltaics
Molecular, crystal and electronic engineering of non-fullerene acceptors
Pi-extension and fluoro-substitution
Core derivatization
Ring-fusion, linker and torsional angle
Molecular, Crystal and Electronic Engineering of NFAs
Molecular, Crystal and Electronic Engineering of NFAs
Pi-Extension and Fluoro-Substitution of NFAs.
Pi-Extension and Fluoro-Substitution of NFAs.
Device Performance of
Device Performance of
PBDB-TF:Y6 NFAs
PBDB-TF:Y6 NFAs
Ring-Fusion, Linker Length and
Ring-Fusion, Linker Length and
Torsional Angle
Torsional Angle
Catalytic Reaction Mechanisms
Catalytic Reaction Mechanisms
The origins of syn stereoselectivity in photocatalyzed [2+2] reactions on CdSe quantum dots
The pathway of complex, submerged barrier, auto-catalyzed lithium-halogen dance reactions
The Origins of Syn Stereoselectivity in Photocatalyzed [2+2] Reactions on CdSe Quantum Dots
The Origins of Syn Stereoselectivity in Photocatalyzed [2+2] Reactions on CdSe Quantum Dots
Halogen Dance Reactions
Halogen Dance Reactions
Theory Development
Theory Development
Quantum embedding:
Domain Separation (DS)
Domain separation (DS) for reaction barriers and excitations
Locally Coupled Open Subsystems (LCOS) for electronic structure
Literature perspectives:
Charge transport (JPC C)
Quantum embedding for materials (JACS)
Quantum embedding in DS and LCOS (IJQC)
Domain separation (DS) for Reaction Barriers and Excitations
Domain separation (DS) for Reaction Barriers and Excitations
Locally Coupled Open Subsystems (LCOS) for Electronic Structure
Locally Coupled Open Subsystems (LCOS) for Electronic Structure
Charge Transport:
Charge Transport:
JPC C Perspective
JPC C Perspective
DS and LCOS:
DS and LCOS:
IJQC Perspective
IJQC Perspective
Quantum Embedding:
Quantum Embedding:
JACS Perspective
JACS Perspective
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