Volume 4; Issue 1

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Computation
Volume 4; Issue 1

Computation

Volume 4; Issue 1

1

Reduced Numerical Model for Methane Hydrate Formation under Conditions of Variable Salinity. Time-Stepping Variants and Sensitivity

Peszynska, Malgorzata, Medina, Francis, Hong, Wei-Li, Torres, Marta

Journal:

Year:

2015

Language:

english

File:

PDF, 663 KB

english, 2015

2

Extracting Conformational Ensembles of Small Molecules from Molecular Dynamics Simulations: Ampicillin as a Test Case

Malloci, Giuliano, Serra, Giovanni, Bosin, Andrea, Vargiu, Attilio

Journal:

Year:

2016

Language:

english

File:

PDF, 6.43 MB

english, 2016

3

Computation of the Likelihood of Joint Site Frequency Spectra Using Orthogonal Polynomials

Vogl, Claus, Bergman, Juraj

Journal:

Year:

2016

Language:

english

File:

PDF, 495 KB

english, 2016

4

Applications of Computational Modelling and Simulation of Porous Medium in Tissue Engineering

German, Carrie, Madihally, Sundararajan

Journal:

Year:

2016

Language:

english

File:

PDF, 462 KB

english, 2016

5

CFD Simulation and Experimental Analyses of a Copper Wire Woven Heat Exchanger Design to Improve Heat Transfer and Reduce the Size of Adsorption Beds

Journal:

Year:

2016

Language:

english

File:

PDF, 16.13 MB

english, 2016

6

A New Method to Infer Advancement of Saline Front in Coastal Groundwater Systems by 3D: The Case of Bari (Southern Italy) Fractured Aquifer

Masciopinto, Costantino, Palmiotta, Domenico

Journal:

Year:

2016

Language:

english

File:

PDF, 1.81 MB

english, 2016

7

Contact Angle Effects on Pore and Corner Arc Menisci in Polygonal Capillary Tubes Studied with the Pseudopotential Multiphase Lattice Boltzmann Model

Son, Soyoun, Chen, Li, Kang, Qinjun, Derome, Dominique, Carmeliet, Jan

Journal:

Year:

2016

Language:

english

File:

PDF, 3.14 MB

english, 2016

8

Direct Numerical Simulation of Turbulent Channel Flow on High-Performance GPU Computing System

Alfonsi, Giancarlo, Ciliberti, Stefania, Mancini, Marco, Primavera, Leonardo

Journal:

Year:

2016

Language:

english

File:

PDF, 11.81 MB

english, 2016

9

Influence of the Localization of Ge Atoms within the Si(001)(4 × 2) Surface Layer on Semicore One-Electron States

Tkachuk, Olha, Terebinskaya, Maria, Lobanov, Victor, Arbuznikov, Alexei

Journal:

Year:

2016

Language:

english

File:

PDF, 1.39 MB

english, 2016

10

Bonding Strength Effects in Hydro-Mechanical Coupling Transport in Granular Porous Media by Pore-Scale Modeling

Chen, Zhiqiang, Xie, Chiyu, Chen, Yu, Wang, Moran

Journal:

Year:

2016

Language:

english

File:

PDF, 6.50 MB

english, 2016

11

Modeling Groundwater Flow in Heterogeneous Porous Media with YAGMod

Cattaneo, Laura, Comunian, Alessandro, de Filippis, Giovanna, Giudici, Mauro, Vassena, Chiara

Journal:

Year:

2015

Language:

english

File:

PDF, 1.50 MB

english, 2015

12

Acknowledgement to Reviewers of Computation in 2015

Journal:

Year:

2016

Language:

english

File:

PDF, 653 KB

english, 2016

13

A Test of Various Partial Atomic Charge Models for Computations on Diheteroaryl Ketones and Thioketones

Journal:

Year:

2016

Language:

english

File:

PDF, 2.41 MB

english, 2016

14

A Test of Various Partial Atomic Charge Models for Computations on Diheteroaryl Ketones and Thioketones

Journal:

Year:

2016

File:

PDF, 2.41 MB

2016

15

Enhancing Computational Precision for Lattice Boltzmann Schemes in Porous Media Flows

Gray, Farrel, Boek, Edo

Journal:

Year:

2016

Language:

english

File:

PDF, 1.74 MB

english, 2016

16

Localized Polycentric Orbital Basis Set for Quantum Monte Carlo Calculations Derived from the Decomposition of Kohn-Sham Optimized Orbitals

Amovilli, Claudio, Floris, Franca, Grisafi, Andrea

Journal:

Year:

2016

File:

PDF, 561 KB

2016