Recent Progress in Computational Sciences and Engineering (2 vols)
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212

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Published By CRC Press

9789004155428, 9781466564510

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Parallel Chain Convergence of Time Dependent Origin-Destination Matrices with Gibbs Sampler

Recent Progress in Computational Sciences and Engineering (2 vols) ◽

10.1201/b12066-9 ◽

2006 ◽

pp. 834-837

Author(s):

Yow-Jen Jou ◽

Hsun-Jung Cho ◽

Chien-Lun Lan ◽

Chia-Chun Hsu

Keyword(s):

Gibbs Sampler ◽

Time Dependent ◽

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Theoretical Modeling of Infrared Spectra of Cyclic Acetylsalicylic Acid Dimer and its Deuterated Derivative

Recent Progress in Computational Sciences and Engineering (2 vols) ◽

10.1201/b12066-87 ◽

2006 ◽

pp. 1124-1133

Author(s):

Houcine Ghalla ◽

Najeh Rekik ◽

Noureddine Issaoui ◽

Brahim Oujia ◽

Marek Wójcik

Keyword(s):

Acetylsalicylic Acid ◽

Infrared Spectra ◽

Theoretical Modeling ◽

Deuterated Derivative

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H/D Isotope Effect on The Lithium Bonded Cluster by ab initio Path Integral Molecular Dynamics Simulation

Recent Progress in Computational Sciences and Engineering (2 vols) ◽

10.1201/b12066-81 ◽

2006 ◽

pp. 1098-1101

Author(s):

A Hayashi ◽

M Shiga ◽

M Tachikawaa

Keyword(s):

Molecular Dynamics ◽

Molecular Dynamics Simulation ◽

Ab Initio ◽

Isotope Effect ◽

Path Integral ◽

Dynamics Simulation

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Statistical Estimation of Dynamic Tobit Models

Recent Progress in Computational Sciences and Engineering (2 vols) ◽

10.1201/b12066-8 ◽

2006 ◽

pp. 830-833

Author(s):

Yow-Jen Jou ◽

Wan-Ru Chang ◽

Chien-Lun Lan

Keyword(s):

Statistical Estimation ◽

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Computational Methods in Chemical Engineering

Recent Progress in Computational Sciences and Engineering (2 vols) ◽

10.1201/b12066-75 ◽

2006 ◽

pp. 1078-1078

Author(s):

G Verros

Keyword(s):

Computational Methods ◽

Chemical Engineering

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Current Studies of Few-Electron Systems

Recent Progress in Computational Sciences and Engineering (2 vols) ◽

10.1201/b12066-64 ◽

2006 ◽

pp. 1035-1038 ◽

Author(s):

Frank Harris

Keyword(s):

Electron Systems

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Quantum-classical correspondence for the kinetic energy

Recent Progress in Computational Sciences and Engineering (2 vols) ◽

10.1201/b12066-63 ◽

2006 ◽

pp. 1031-1034

Author(s):

I Hamilton ◽

Ricardo Mosna ◽

L Site

Keyword(s):

Kinetic Energy ◽

Classical Correspondence

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Electronic properties of solvated duplex DNAs by DFT calculations

Recent Progress in Computational Sciences and Engineering (2 vols) ◽

10.1201/b12066-61 ◽

2006 ◽

pp. 1022-1025

Author(s):

T Tsukamoto ◽

Y Ishikawa ◽

M Vilkas ◽

T Natsume ◽

K Dedachi ◽

...

Keyword(s):

Dft Calculations ◽

Electronic Properties

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Size Measures of Molecular Electron Densities – From the Smith Measure of Electron Pairs to Local and Global Macromolecular Measures

Recent Progress in Computational Sciences and Engineering (2 vols) ◽

10.1201/b12066-57 ◽

2006 ◽

pp. 1008-1011

Author(s):

P Mezey

Keyword(s):

Electron Densities ◽

Electron Pairs ◽

Molecular Electron

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Understanding Superconductivity

Recent Progress in Computational Sciences and Engineering (2 vols) ◽

10.1201/b12066-56 ◽

2006 ◽

pp. 1004-1007

Author(s):

Sven Larsson

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