Nanomaterials: Design and Simulation - Theoretical and Computational Chemistry
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Chapter 5 Structural characterization of nano- and mesoporous materials by molecular simulations

Nanomaterials: Design and Simulation - Theoretical and Computational Chemistry ◽

10.1016/s1380-7323(06)80007-5 ◽

2007 ◽

pp. 101-126 ◽

Cited By ~ 5

Author(s):

Lourdes F. Vega

Keyword(s):

Mesoporous Materials ◽

Structural Characterization ◽

Molecular Simulations

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Chapter 3 Computer simulation of the solid-liquid phase transition in alkali metal nanoparticles

Nanomaterials: Design and Simulation - Theoretical and Computational Chemistry ◽

10.1016/s1380-7323(06)80005-1 ◽

2007 ◽

pp. 59-83

Author(s):

Andrés Aguado ◽

José M. López

Keyword(s):

Phase Transition ◽

Computer Simulation ◽

Liquid Phase ◽

Alkali Metal ◽

Metal Nanoparticles ◽

Liquid Phase Transition ◽

Solid Liquid

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Chapter 6 Hydrogen adsorption in corannulene-based materials

Nanomaterials: Design and Simulation - Theoretical and Computational Chemistry ◽

10.1016/s1380-7323(06)80008-7 ◽

2007 ◽

pp. 127-166 ◽

Cited By ~ 4

Author(s):

Yingchun Zhang ◽

Lawrence G. Scanlon ◽

Perla B. Balbuena

Keyword(s):

Hydrogen Adsorption

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Index

Nanomaterials: Design and Simulation - Theoretical and Computational Chemistry ◽

10.1016/s1380-7323(06)80015-4 ◽

2007 ◽

pp. 317-319

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Preface

Nanomaterials: Design and Simulation - Theoretical and Computational Chemistry ◽

10.1016/s1380-7323(06)80002-6 ◽

2007 ◽

pp. vii

Author(s):

Perla B. Balbuena ◽

Jorge M. Seminario

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Chapter 4 Multiscale modeling of the synthesis of quantum nanodots and their arrays

Nanomaterials: Design and Simulation - Theoretical and Computational Chemistry ◽

10.1016/s1380-7323(06)80006-3 ◽

2007 ◽

pp. 85-99

Author(s):

Narayan Adhikari ◽

Xihong Peng ◽

Azar Alizadeh ◽

Saroj Nayak ◽

Sanat K. Kumar

Keyword(s):

Multiscale Modeling

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Chapter 11 Ab initio simulations of photoinduced molecule-semiconductor electron transfer

Nanomaterials: Design and Simulation - Theoretical and Computational Chemistry ◽

10.1016/s1380-7323(06)80013-0 ◽

2007 ◽

pp. 275-300 ◽

Cited By ~ 2

Author(s):

Walter R. Duncan ◽

William Stier ◽

Oleg V. Prezhdo

Keyword(s):

Electron Transfer ◽

Ab Initio ◽

Ab Initio Simulations

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Chapter 2 Structural properties of pure and binary nanoclusters investigated by computer simulations

Nanomaterials: Design and Simulation - Theoretical and Computational Chemistry ◽

10.1016/s1380-7323(06)80004-x ◽

2007 ◽

pp. 35-58

Author(s):

Giulia Rossi ◽

Riccardo Ferrando

Keyword(s):

Structural Properties ◽

Computer Simulations

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Chapter 12 Nano-particulate photocatalysts for overall water splitting under visible light

Nanomaterials: Design and Simulation - Theoretical and Computational Chemistry ◽

10.1016/s1380-7323(06)80014-2 ◽

2007 ◽

pp. 301-315 ◽

Cited By ~ 3

Author(s):

Kazuhiko Maeda ◽

Kazunari Domen

Keyword(s):

Visible Light ◽

Water Splitting ◽

Overall Water Splitting

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Chapter 9 Modeling and simulations of carbon nanotubes

Nanomaterials: Design and Simulation - Theoretical and Computational Chemistry ◽

10.1016/s1380-7323(06)80011-7 ◽

2007 ◽

pp. 227-244

Author(s):

Alper Buldum

Keyword(s):

Carbon Nanotubes ◽

Modeling And Simulations

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Nanomaterials: Design and Simulation - Theoretical and Computational ChemistryLatest Publications

TOTAL DOCUMENTS

H-INDEX

Published By Elsevier

Chapter 5 Structural characterization of nano- and mesoporous materials by molecular simulations

Chapter 3 Computer simulation of the solid-liquid phase transition in alkali metal nanoparticles

Chapter 6 Hydrogen adsorption in corannulene-based materials

Index

Preface

Chapter 4 Multiscale modeling of the synthesis of quantum nanodots and their arrays

Chapter 11 Ab initio simulations of photoinduced molecule-semiconductor electron transfer

Chapter 2 Structural properties of pure and binary nanoclusters investigated by computer simulations

Chapter 12 Nano-particulate photocatalysts for overall water splitting under visible light

Chapter 9 Modeling and simulations of carbon nanotubes

Nanomaterials: Design and Simulation - Theoretical and Computational Chemistry
Latest Publications