Modeling & Simulation at the Nanoscale

Modeling & Simulation at the Nanoscale

Symposium Co-Chairs

Michael MakowskiMichael Makowski
Group Leader, Applied Scientific Computing
PPG Industries R&D

Confirmed Invited Speakers

Richard R. BartoIntegrated Multiscale Modeling for Rapid Flexible Manufacturing, Approaches and Challenges
Richard R. Barto
Manager, Computational Physics Group, Lockheed Martin Advanced Technology Labs
Gerhard  KlimeckGerhard Klimeck
Director, Network for Computational Nanotechnology
Purdue University
Amanda S.  BarnardNovel Modeling Methods & Theory for Photocatalysis Design
Amanda S. Barnard
Australian Research Council Queen Elizabeth II Fellow and head, Virtual Nanoscience Laboratory, CSIRO, Australia
Irene Yarovsky Nanoscale engineering of responsive surfaces for contamination resistance
Irene Yarovsky
Program Leader for Biophysics and Bioengineering, RMIT University, Australia, Australia

Symposium Sessions

Tuesday June 19

12:30 Networking Lunch - Expo
4:30 Expo Reception and Poster Session I (4:30 - 6:30)
 Modeling & Simulation at the Micro and Nanoscale

Wednesday June 20

8:30 Modeling & Simulation at the Nanoscale: Keynotes
11:00 Polymer Nanotech: Modeling & Simulation of Polymer Nanostructures
12:30 Networking Lunch - Expo
1:00 NNI - Director’s Networking Session, National Nanotechnology Coordination Office
1:30 Exhibit and Poster Session II
 Modeling & Simulation at the Micro and Nanoscale
3:30 Modeling & Simulation at the Nanoscale
5:30 TechConnect Innovation Showcase Reception
6:00 CTSI Utility Technology Challenge Awards and Reception

Thursday June 21

8:30 NanoHUB Nanoscale Modeling & Simulation Workshop
10:00 National Nanotechnology Initiative Triennial Review
11:00 Bio Nano Materials: Modeling & Simulation of Bionanomaterials
12:30 National Innovation Showcase - Networking Lunch (available for purchase)
4:00 TechConnect National Innovation Showcase, Reception & Poster Session III

Symposium Program

Tuesday June 19

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12:30Networking Lunch - ExpoExpo Hall AB
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4:30Expo Reception and Poster Session I (4:30 - 6:30)Expo Hall AB
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Modeling & Simulation at the Micro and Nanoscale
-Electron pairing instabilities and magnetic properties in nanoclusters and nanomaterials
A.N. Kocharian, G.W. Fernando, K. Fung, K. Palandage, California State University Los Angeles, US
-Rendering techniques for molecular visualization on mobile devices
B.J. Larson, Sunset Lake Software LLC, US
-Temperature-Controlled Molecular Dynamics Study on Velocity-Dependent Threshold Behavior of Nano-Friction
K. Hayashi, T. Mori, R. Taniguchi, K. Nakamura, Kanazawa Institute of Technology, JP
-Molecular Dynamics Simulation of Sensor-Enabled Geosynthetics
K. Hatami, H. Yazdani, T. Hawa, B.P. Grady, University of Oklahoma, US
-Bionanobots for drug delivery
M. Aurelio, C. Pacheco, PUC/RIO, BR
-Static and Dynamic Properties of the Electrical Double Layer Near Amorphous Silica: Relevance for Device Design
B. Shi, H. Zhang, A. Hassanali, Y.K. Shin, C. Knight, S.J. Singer, Ohio State University, US
-The Structure of Agglomerates consisting of Polydisperse Particles
M.L. Eggersdorfer, S.E. Pratsinis, ETH Zurich, CH
-Drift Velocity Calculation in Si Using an Analytical Model for the Phonon Dispersion
M. Gada, D. Vasileska, K. Raleva, S.M. Goodnick, Arizona State University, US
-Precise Simulation of Freezing Transitions
M. Nayhouse, G. Orkoulas, UCLA, US
-Interfacial effects and diffusion transport regimes in nanofluidic systems
A. Ziemys, M. Milosevic, M. Ferrari, M. Kojic, The Methodist Hospital Research Institute, US
-Analytical Drain Current Model for Damaged Gate All Around (GAA) MOSFET Including Quantum and Velocity Overshoot Effects
R. Gautam, M. Saxena, R.S. Gupta, M. Gupta, University of Delhi, South Campus, IN
-Rapid oxidation and self-heating model of aluminum spherical nanoparticles
M. Zyskin, K.S. Martirosyan, University of Texas at Brownsville, US
-Modeling Spray Coating of Polymer Thin Film Photovoltaic Solar Cells
M. Eslamian and M. Dashti, Texas A&M University-Corpus Christi, US
-Multiscale flow behaviors of hydrogen and oxygen gas based on the coupled DSMC-SPH approach
J. Ye, J. Yang, J. Zheng, X. Ding, L. Wong, W. Li, C. Chen, Zhejiang University, CN
-Modeling and Simulation of Surface Acoustic Wave Chemical Sensors
M. Husak, A. Laposa, J. Kroutil, Czech Technical University in Prague, Faculty of Electrical Engineering, CZ
-Simulation of Gas Flows in Micro Devices by Solving the Boltzmann Kinetic Equation
Yu.A. Anikin, O.I. Dodulad, Yu.Yu. Kloss, D.V. Martynov, F.G. Tcheremissine, P.V. Shuvalov, Moscow Institute of Physics and Technology, National research centre “Kurchatov institute”, RU
-Finite Element Modeling investigation On The Effect Of Nose Radius On Machining Parameters For Titanium (Ti-6Al-4V) Alloy
M.H. Ali, B. Mohamed, M.N.M. Ansari, G.H.K. Rao, B.A. Khidhir, Universiti Tenaga Nasional, MY

Wednesday June 20

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8:30Modeling & Simulation at the Nanoscale: KeynotesGrand Ballroom E
Session chair: Michael Makowski, PPG Industries, US
8:30Novel Modeling Methods & Theory for Photocatalysis Design
A.S. Barnard, CSIRO, AU (bio)
9:00Integrated Multiscale Modeling for Rapid Flexible Manufacturing, Approaches and Challenges
R.R. Barto, Lockheed Martin, US
9:30Nanoscale engineering of responsive surfaces for contamination resistance
G. Yiapanis, L. Shaw, K. Ley, D. Henry, S. Maclaughlin, E. Evans, I. Yarovsky, RMIT University, AU
10:00High-Performance Computing for Atomistic Materials Modeling
G. Klimeck, Purdue University, US
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11:00Polymer Nanotech: Modeling & Simulation of Polymer NanostructuresGrand Ballroom E
Session chair: Michael Makowski, PPG Industries, US
11:00Multifunctional Nanocomposites: Modeling and Characterization
J.M. Wernik, S.A. Meguid, University of Toronto, CA
11:20Computer Modeling Of Star Polymer Molecules With Diblock Arms
W. Swope, IBM Almaden Research Center, US
11:40Micromechanical Analysis of Polymer-Nanofiber Composites
C.R. Locker, J. Bergstrom, X. Liu, A.H. Tsou, V.B. Buchholz, A.K. Mehta, ExxonMobil Research and Engineering, US
12:00Nanotribology and Lubrication at Nanoscale: Molecular Dynamics Simulation Studies
A. Jabbarzadeh, The University of Sydney, AU
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12:30Networking Lunch - ExpoExhibit Hall AB
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1:00NNI - Director’s Networking Session, National Nanotechnology Coordination OfficeExhibit Hall A
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1:30Exhibit and Poster Session IIExhibit Hall AB
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Modeling & Simulation at the Micro and Nanoscale
-Switching and Release Dynamics of an Electrostatically Actuated MEMS Switch under the influence of Squeeze-film Damping
S. Shekhar, K.J. Vinoy, G.K. Ananthasuresh, Indian Institute of Science, IN
-FEM study of a 3-axis thermal accelerometer based on free convection in a microcavity
H.B. Nguyen, F. Mailly, L. Latorre, P. Nouet, University Montpellier 2 / CNRS - LIRMM, FR
-Novel Nanoelectromechanical Relay Design Procedure for Logic and Memory Applications
X. Rottenberg, V. Rochus, R. Jansen, M. Ramezani, S. Severi, A. Witvrouw, H.A.C. Tilmans, Imec, BE
-Linearity evaluation of Silicon Nanowire Surrounding Gate MOSFET for high performance ULSI applications
N. Aggarwal, K. Sikka, I. Gupta, R. Chaujar, Delhi Technological University, IN
-Gas Sensor with SAW Structures
A. Laposa, M. Husak, J. Kroutil, Czech Technical University in Prague, Faculty of Electrical Engineering, CZ
-Novel Structure of CMOS Voltage-to-Current Converter for High-Voltage Applications
M. Jankowski, A. Napieralski, Technical University of Lodz, PL
-Simulation of Removal of Surface-State-Related Lag and Current Slump in GaAs FETs
H. Hafiz, M. Kumeno, K. Horio, Shibaura Institute of Technology, JP
-Research on Non-linear Vibration in Micro-machined Resonant Accelerometer
Z. Shuming, L. Yunfeng, W. Fan, D. Jingxin, Tsinghua University, CN
-A Numerical Study on THZ-Wave Generation and Detection of Metal-Oxide-Semiconductor Field-effect Transistor
C. Wang, X. Mou, J. He, Y. Ye, H. He, Y. Cao, PKU-HKUST Shenzhen-Hongkong Institution, CN
-Simulation of a High Compliant Micro Electromagnetic Generator for Energy Harvesting
G-Y Wu, S-J Chen, National Central University, TW
-Electric Double Layer Simulation on Transient State for Sensitivity Enhancement of Affinity-Based Biosensor
J.-M. Woo, S.H. Kim, Y.J. Park, Seoul National University, KR
-Field-Based 3D Capacitance Modeling for sub-45-nm On-Chip Interconnect
A. Zhang, W. Zhao, Y. Ye, J. He, A. Chen, M. Chan, Beijing University of Aeronautics and Astronautics, CN
-A Charge Based Non-Quasi-Static Transient Model for SOI MOSFETs
J. Zhang, J. He, Y. Ye, H. He, M. Chan, Peking University, CN
-Physics based Analytical Model for a Pocket Doped p-n-p-n Tunnel Field Effect Transistor
R. Narang, M. Saxena, R.S. Gupta, M. Gupta, University of Delhi South Campus, IN
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3:30Modeling & Simulation at the NanoscaleGrand Ballroom E
Session chair: Michael Makowski, PPG Industries, US
3:30Modeling of gas dynamic behaviour of CCSO in nanostructured media
A.A. Markov, I.A. Filimonov, K.S. Martirosyan, University of Texas at Brownsville, US
3:50Chemical Equilibrium Unique to Nano-Systems: Confinement vs. Quasi-Confinement Effects
M. Polak, L. Rubinovich, Ben-Gurion University of the Negev, IL
4:10Controlling Oxidation Reaction on Platinum by Spin Manipulation
M.C. Sison Escaño, T.Q. Nguyen, H. Nakanishi, H. Kasai, Osaka University, JP
4:30Electronic Structure and Band Gap Engineering of ZnO-based Semiconductor Alloy Films
P-L Liu, P-T Shao, National Chung Hsing University, TW
4:50Dynamic Crack Propagation in a Bi-Metallic Nanolayer
R. Mohan, North Carolina A&T State University, US
5:10Quantum Chemical Molecular Dynamics Study of Oxidation Process on Fe-Cr Alloy Surfaces in High Temperature Water
K. Suzuki, H. Miura, Tohoku University, JP
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5:30TechConnect Innovation Showcase ReceptionExpo Hall CD
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6:00CTSI Utility Technology Challenge Awards and ReceptionExpo Theater 1
Session chair: Patti Glaza, Arsenal Venture Partners, US

Thursday June 21

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8:30NanoHUB Nanoscale Modeling & Simulation WorkshopGreat America 2
Session chair: Gerhard Klimeck, Network for Computational Nanotechology, Purdue, US
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10:00National Nanotechnology Initiative Triennial ReviewGreat America 1
Session chair: Erik Svedberg, National Materials and Manufacturing, National Academies, US
10:00NNI Town Hall Meeting
E. Svedberg, National Nanotechnology Initiative, US
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11:00Bio Nano Materials: Modeling & Simulation of BionanomaterialsRoom 209
Session chair: Liz A. Davies, Soft Matter (RSC), US
11:00Controlling Morphology of Bio-nanostructured Materials via Self-Assembly of Amphiphilic Lipids and Functionalized Nanotubes
M. Dutt, O. Kuksenok, A.C. Balazs, Rutgers University, US
11:20Structural conformations of ATP/Mg:ATP and Mg2+ coordinating dynamics in motor proteins
A. Bojovschi, M.S. Liu, R.J. Sadus, Swinburne University of Technology, AU
11:40The density of peptide-MHC ligands within nanoscale oligomers influences T-cell receptor mediated signaling
Y. Sykulev, Thomas Jefferson University, US
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12:30National Innovation Showcase - Networking Lunch (available for purchase)Expo Hall CD
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4:00TechConnect National Innovation Showcase, Reception & Poster Session IIIExpo Hall CD

Special Symposium

Following on the 14 year history of the International Conference on Computational Nanotechnology (ICCN) this special symposium provides the most comprehensive forum for the multidisciplinary nano design, modeling and simulation community. The event will feature presentations on the latest applications-focused research and development in computational methods, tools and simulation at the nanoscale. You are invited to submit on topics ranging from theoretical developments through industry-oriented applications

Topics & Application Areas

  • Molecular Modeling
  • Multiscale Modeling
  • Nanomaterials design using quantum chemistry
  • Novel modeling methods & theory
  • Modeling & simulation of polymer nanostructures
  • Modeling catalytic surfaces & reactions
  • Other

Journal Submissions

Molecular Simulation

Molecular Simulation

Selected Nanotech Proceedings papers will be reviewed and invited into a Special Issue of Molecular Simulation. The journal covers all aspects of research related to, or of importance to, molecular modelling and simulation (including informatics, theoretical and experimental work).

For consideration into this Special Issue of Molecular Simulations, please select the “Submit to Molecular Simulation” button during the on-line submission procedure.

 

Sponsor & Exhibitor Opportunities

 Exhibit and Showcase
 Become a Sponsor

Please contact: Denise Lee


Program Tracks

Fabrication & Characterization

Advanced Materials

Electronics & Microsystems

Medical & Biotech

Energy & Environment

Business & Partnering

 

2012 TechConnect Corporate Acceleration Partners:

AC-NET
Applied Materials
Austin_Energy
BASF
BayerMaterialScience
bp
ConstellationEnergy
DOW
Fraunhofer TechBridge
Hitachi
Honda
IBM
Kauffman Foundation
Kodak
Lam
Lockheed Martin
MWV
nationalgrid
NortheastUtilities
novaris
Panasonic
PPG
Samsung
schlumberger
Shell_GameChanger
siemens
SK Innovation
SouthernCalEdison
Toray

In Partnership with

NSTI


Sponsorship Opportunities: Contact Denise Lee

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