Computational Chemistry: Reviews of Current Trends
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Published By WORLD SCIENTIFIC

9789812560971, 9789812701305

Latest Documents Most Cited Documents Contributed Authors Related Sources Related Keywords

Molecular Dynamics Simulations of a Molecular Electronics Device: The NanoCell

Computational Chemistry: Reviews of Current Trends ◽

10.1142/9789812701305_0003 ◽

2005 ◽

pp. 85-119 ◽

Cited By ~ 5

Author(s):

Jorge Seminario ◽

Pedro Derosa ◽

Luis Cordova ◽

Brian Bozard

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulations ◽

Molecular Electronics ◽

Dynamics Simulations

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Is a Dihydrogen Bond a Unique Phenomenon?

Computational Chemistry: Reviews of Current Trends ◽

10.1142/9789812701305_0006 ◽

2005 ◽

pp. 195-235

Author(s):

Slawomir J. Grabowski ◽

Jerzy Leszczynski

Keyword(s):

Dihydrogen Bond

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BACK MATTER

Computational Chemistry: Reviews of Current Trends ◽

10.1142/9789812701305_bmatter ◽

2005 ◽

pp. 237-246

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Molecular Electronics with Gaussian98/03

Computational Chemistry: Reviews of Current Trends ◽

10.1142/9789812701305_0001 ◽

2005 ◽

pp. 1-46 ◽

Cited By ~ 6

Author(s):

J. J. Palacios ◽

A. J. Pérez-Jiménez ◽

E. Louis ◽

E. SanFabián ◽

J. A. Vergés ◽

...

Keyword(s):

Molecular Electronics

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Molecular Dynamics Simulations of Single Molecule Atomic Force Microscope Experiments

Computational Chemistry: Reviews of Current Trends ◽

10.1142/9789812701305_0002 ◽

2005 ◽

pp. 47-83 ◽

Cited By ~ 7

Author(s):

Wiesław Nowak ◽

Piotr E. Marszałek

Keyword(s):

Molecular Dynamics ◽

Atomic Force Microscope ◽

Molecular Dynamics Simulations ◽

Single Molecule ◽

Atomic Force ◽

Dynamics Simulations

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FRONT MATTER

Computational Chemistry: Reviews of Current Trends ◽

10.1142/9789812701305_fmatter ◽

2005 ◽

pp. i-ix

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Modelling of Anisotropic Exchange Coupling in Rare-Earth–Transition-Metal Pairs: Applications to Yb3+-Mn2+ and Yb3+-Cr3+ Halide Clusters and Implications to the Light Up-Conversion

Computational Chemistry: Reviews of Current Trends ◽

10.1142/9789812701305_0005 ◽

2005 ◽

pp. 153-194 ◽

Cited By ~ 1

Author(s):

M. Atanasov ◽

C. Daul ◽

H. U. Güdel

Keyword(s):

Rare Earth ◽

Transition Metal ◽

Exchange Coupling ◽

Anisotropic Exchange

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Computation of Excited State Potential Energy Surfaces via Linear Response Theories Based on State Specific Multi-Reference Coupled Electron-Pair Approximation Like Methods

Computational Chemistry: Reviews of Current Trends ◽

10.1142/9789812701305_0004 ◽

2005 ◽

pp. 121-151 ◽

Cited By ~ 1

Author(s):

Sudip Chattopadhyay ◽

Dola Pahari ◽

Uttam Mahapatra ◽

Debashis Mukherjee

Keyword(s):

Excited State ◽

Potential Energy ◽

Linear Response ◽

Potential Energy Surfaces ◽

Electron Pair ◽

Pair Approximation ◽

State Potential ◽

Energy Surfaces

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Computational Chemistry: Reviews of Current TrendsLatest Publications

TOTAL DOCUMENTS

H-INDEX

Published By WORLD SCIENTIFIC

Molecular Dynamics Simulations of a Molecular Electronics Device: The NanoCell

Is a Dihydrogen Bond a Unique Phenomenon?

BACK MATTER

Molecular Electronics with Gaussian98/03

Molecular Dynamics Simulations of Single Molecule Atomic Force Microscope Experiments

FRONT MATTER

Modelling of Anisotropic Exchange Coupling in Rare-Earth–Transition-Metal Pairs: Applications to Yb3+-Mn2+ and Yb3+-Cr3+ Halide Clusters and Implications to the Light Up-Conversion

Computation of Excited State Potential Energy Surfaces via Linear Response Theories Based on State Specific Multi-Reference Coupled Electron-Pair Approximation Like Methods

Computational Chemistry: Reviews of Current Trends
Latest Publications