Chemical Modelling
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Published By Royal Society Of Chemistry

9781849734127
Latest Documents Most Cited Documents Contributed Authors Related Sources Related Keywords

On choosing the best density functional approximation

2012 ◽  
pp. 168-185 ◽  
Author(s):  
Bartolomeo Civalleri ◽  
Davide Presti ◽  
Roberto Dovesi ◽  
Andreas Savin
Keyword(s):  
Density Functional ◽  
Functional Approximation

Uncovering molecular secrets of ionic liquids

2012 ◽  
pp. 1-24 ◽  
Author(s):  
Stefan Zahn ◽  
Barbara Kirchner
Keyword(s):  
Ionic Liquids

Contents

2012 ◽  
pp. P007-P009

Modeling biological cells

2012 ◽  
pp. 61-91 ◽  
Author(s):  
Raja Paul
Keyword(s):  
Biological Cells

Particle based multiscale simulation methods and applications

2012 ◽  
pp. 92-134 ◽  
Author(s):  
Sudip Roy
Keyword(s):  
Multiscale Simulation ◽  
Simulation Methods

Preface

2012 ◽  
pp. P005-P005
Author(s):  
Michael Springborg

Size-dependent electronic structure of semiconductor nanoparticles

2012 ◽  
pp. 135-167 ◽  
Author(s):  
Sougata Pal ◽  
Sunandan Sarkar ◽  
Supriya Saha ◽  
Pranab Sarkar
Keyword(s):  
Electronic Structure ◽  
Semiconductor Nanoparticles ◽  
Size Dependent

Front Matter

2012 ◽  
pp. P001-P004

Interaction-induced electric properties

2012 ◽  
pp. 25-60 ◽  
Author(s):  
George Maroulis
Keyword(s):  
Electric Properties
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