Symposium Organizers
Timothy Rupert, University of California, Irvine
Fadi Abdeljawad, Clemson
Julie Cairney, The University of Sydney
Jason Trelewicz, Stony Brook University
CP04.00: Late News in Interfacial Science and Engineering
Session Chairs
Jessica Krogstad
Timothy Rupert
Monday PM, April 22, 2019
PCC North, 100 Level, Room 124 A
1:30 PM - CP04.00.01
Solute Segregation and Grain Boundary Transport in Nanocrystalline Alloys—Insight from Diffusion Triples
Jessica Krogstad1,2,Pralav Shetty1,2,Caelin Muir1
University of Illinois, Urbana-Champaign1,University of Illinois at Urbana-Champaign2
Show AbstractAbstracts will be available March 26.
1:45 PM - CP04.00.02
Surface Energy Interactions in Crystalline Coffee Rings
Samantha McBride1,Rachael Skye1,Kripa Varanasi1
Massachusetts Institute of Technology1
Show AbstractAbstracts will be available March 26.
2:00 PM - CP04.00.03
Evolution of Persistent Metastable Phases During Mg Metal Corrosion
Suntharampillai Thevuthasan1,Vaithiyalingam Shutthanandan1,Abraham Martinez1,Peter Sushko1,Arun Devaraj1,Olga Marina1,Vineet Joshi1,Vijayakumar Murugesan1
Pacific Northwest National Laboratory1
Show AbstractAbstracts will be available March 26.
2:15 PM - CP04.00.04
Kinetics and Mechanism of Surface-Guided Nanowire Growth
Amnon Rothman1,Vladimir Dubrovskii2,3,Ernesto Joselevich1
Weizmann Institute of Science1,ITMO University2,Ioffe Physical Technical Institute of the Russian Academy of Sciences3
Show AbstractAbstracts will be available March 26.
2:30 PM - CP04.00.05
Understanding Surface Degradation and Ligand Passivation-Assisted Stability of Hybrid Perovskites in Water Using Molecular Dynamics Simulations
Huanhuan Zhou1,Mingchao Wang2,Jingfan Wang1,Shangchao Lin3
Florida State University1,Monash University2,Shanghai Jiao Tong University3
Show AbstractAbstracts will be available March 26.
3:15 PM - CP04.00.06
Waterbowls—Reducing Impacting Droplet Interactions by Momentum Redirection
Henri-Louis Girard1,Dan Soto1,Kripa Varanasi1
Massachusetts Institute of Technology1
Show AbstractAbstracts will be available March 26.
3:30 PM - CP04.00.07
Defect Induced Surface Reactivity and Ion Transfer Process in TiO2 Polymorphs
Vijayakumar Murugesan1,Kee Sung Han1,Venkateshkumar Prabhakaran1,Yongsoon Shin1,Tiffany Kaspar1,Mal Soon Lee1,Jaewon Lee1,Vaithiyalingam Shutthanandan1,Suntharampillai Thevuthasan1
Pacific Northwest National Laboratory1
Show AbstractAbstracts will be available March 26.
3:45 PM - CP04.00.08
Bulk-Like Ferromagnetism in Manganite Ultrathin Layers
Sanaz Koohfar1,Divine Kumah1
North Carolina State University1
Show AbstractAbstracts will be available March 26.
4:00 PM - CP04.00.09
Revealing the Role of Interfacial Stress on the Polarization Stability of Lead-Free Relaxor Ceramics
Julia Glaum1,2,Yooun Heo2,Matias Acosta3,Pankaj Sharma2,Jan Seidel2,Manuel Hinterstein4,2
Norwegian University of Science and Technology1,UNSW Australia2,Technische Universität Darmstadt3,Karlsruhe Institute of Technology4
Show AbstractAbstracts will be available March 26.
4:15 PM - CP04.00.10
Atomic Structure During Interface Formation, De-Cohesion and Migration Under In Situ High Resolution TEM
Scott Mao1,Yang He1,Chongmin Wang2
University of Pittsburgh1,Pacific Northwest National Laboratory2
Show AbstractAbstracts will be available March 26.
Symposium Organizers
Timothy Rupert, University of California, Irvine
Fadi Abdeljawad, Clemson
Julie Cairney, The University of Sydney
Jason Trelewicz, Stony Brook University
CP04.01: Interface Structure
Session Chairs
Fadi Abdeljawad
Eric Homer
Tuesday AM, April 23, 2019
PCC West, 100 Level, Room 102 A
10:30 AM - CP04.01.01
Connecting Atomic and Crystallographic Structure-Property Relationships of Grain Boundaries
Eric Homer1,Jonathan Priedeman1,Conrad Rosenbrock1,Oliver Johnson1,Gus Hart1,Srikanth Patala2
Brigham Young University1,North Carolina State University2
Show AbstractAbstracts will be available March 26.
11:00 AM - CP04.01.02
Processing Routes for Controlling Disorder-Property Relationships in Metallic Alloys
Daniel Gianola1,Glenn Balbus1,McLean Echlin1,Charlette Grigorian2,Christoph Gammer3,Daniel Kiener3,Timothy Rupert2,Tresa Pollock1
University of California, Santa Barbara1,University of California, Irvine2,Montanuniversität Leoben3
Show AbstractAbstracts will be available March 26.
11:30 AM - CP04.01.03
Two-Dimensional Polymorphic {111}/{115} Grain Boundaries in Si—Atomistic Structure and Impurity Segregation Ability
Yutaka Ohno1,Hideto Yoshida2,Seiji Takeda2,Tatsuya Yokoi3,Atsutomo Nakamura3,Katsushi Matsunaga3,Yasuo Shimizu1,Naoki Ebisawa1,Koji Inoue1,Yasuyoshi Nagai1
Tohoku University1,Osaka University2,Nagoya University3
Show AbstractAbstracts will be available March 26.
11:45 AM - CP04.01.04
Surface Atomic and Electronic Structure of Ultrathin BaTiO3 Films
Kyle Kelley1,Rama Vasudevan1,Nina Balke Wisinger1
Oak Ridge National Laboratory1
Show AbstractAbstracts will be available March 26.
CP04.02: Mechanically-Driven Transformations and Diffusion
Session Chairs
Eugen Rabkin
Jason Trelewicz
Tuesday PM, April 23, 2019
PCC West, 100 Level, Room 102 A
1:30 PM - CP04.02.01
Interface Diffusion-Controlled Pseudoelasticity of Metal Nanoparticles
Eugen Rabkin1,Amit Sharma1,Nimrod Gazit1,Leonid Klinger1
Department of Materials Science and Engineering, Technion-Israel Institute of Technology1
Show AbstractAbstracts will be available March 26.
2:00 PM - CP04.02.02
Strain Relaxation in Low-Mismatched GaAs/GaAs0.92Sb0.08/GaAs(001) Heterostructures
Abhinandan Gangopadhyay1,Aymeric Maros1,Nikolai Faleev1,David Smith1
Arizona State University1
Show AbstractAbstracts will be available March 26.
2:15 PM - CP04.02.03
Exploring the Impact of Strain and Droplet Formation on Phase Separation and Atomic Ordering in GaAsBi
John McElearney1,Margaret Stevens1,Kevin Grossklaus1,Thomas Vandervelde1
Tufts University1
Show AbstractAbstracts will be available March 26.
2:30 PM - CP04.02.04
Dynamic Investigation of Titanium Disilicide Formation by In Situ TEM
Hsin Mei Lu1,Chih-Yang Huang1,Wen-Wei Wu1
National Chiao Tung University1
Show AbstractAbstracts will be available March 26.
2:45 PM - CP04.02.05
Design and Control of Crystalline Phase Interfaces in Doubly-Epitaxial FeSe Thin Films
Sumner Harris1,Renato Camata1
University of Alabama at Birmingham1
Show AbstractAbstracts will be available March 26.
CP04.03: Tailoring Properties by Controlling Interfacial Structure
Session Chairs
Martin Harmer
Jason Trelewicz
Tuesday PM, April 23, 2019
PCC West, 100 Level, Room 102 A
3:30 PM - CP04.03.01
Grain Boundary Complexion Engineering—A Case Study of Silica and Rare-Earth Doped Boron Suboxide Armor Ceramics
Martin Harmer1,Christopher Marvel1,Kristopher Behler2,3,Jennifer Synowczynski-Dunn2,Jerry LaSalvia2
Lehigh University1,US Army Research Laboratory2,SURVICE Engineering3
Show AbstractAbstracts will be available March 26.
4:00 PM - CP04.03.02
Grain Size Effects on Ni/Al Nanolaminate Combustion
Brandon Witbeck1,2,Douglas Spearot1
University of Florida1,Air Force Research Laboratory2
Show AbstractAbstracts will be available March 26.
4:15 PM - CP04.03.03
In Situ TEM Investigation of Low Resistivity NiSi Formation on Si0.7Ge0.3
An-Yuan Hou1,Chih-Yang Huang1,Kuo Lun Tai1,Wen-Wei Wu1
National Chiao Tung University1
Show AbstractAbstracts will be available March 26.
4:30 PM - CP04.03.04
Study on the Atomic Interaction of Si and Mn During the Eutectoid Transformation in High-Carbon Steel
Linghui Huang1,Yiyou Tu1,Xuefeng Zhou1,Jianqing Jiang2
Southeast University1,Nanjing Forestry University2
Show AbstractAbstracts will be available March 26.
4:45 PM - CP04.03.05
Interatomic Bonds and Elastic Properties of Σ5(210) Grain Boundaries in Ni3Si Compound
Martin Zeleny1,2,Martin Friák3,Monika Vsianska4,3,5,David Holec6,Mojmír Sob4,3,5
Faculty of Mathematics and Physics, Charles University1,Faculty of Mechanical Engineering, Brno University of Technology2,Institute of Physics of Materials, Academy of Sciences of the Czech Republic3,Central European Institute of Technology, CEITEC MU, Masaryk University4,Faculty of Science, Masaryk University5,Montanuniversität Leoben6
Show AbstractAbstracts will be available March 26.
CP04.04: Poster Session: Interfacial Science and Engineering—Mechanics, Thermodynamics, Kinetics and Chemistry
Session Chairs
Fadi Abdeljawad
Julie Cairney
Timothy Rupert
Jason Trelewicz
Tuesday PM, April 23, 2019
PCC North, 300 Level, Exhibit Hall C-E
5:00 PM - CP04.04.01
Mesoscale Interface and Surface Characterization by μ-XRD Mapping on Mosaic and Lateral Grown Single Crystal Diamond
Shengyuan Bai1,Elias Garratt1
Michigan State University1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.02
Analytical Diffuse Layer Models in Electronic Structure Simulations
Matthew Truscott1,Oliviero Andreussi1
University of North Texas1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.03
Computational Investigations of Surface Adsorption of Ethane on M1 Catalyst (Mo-V-Nb-Te-O)
Bryton Anderson1,Matthew Jones1,Eric Jankowski1
Boise State University1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.04
Surface Characteristics of Accident Tolerant Fuels Cladding and their Potential Impact in Critical Heat Flux
Rajnikant Umretiya1,Daniel Ginestro1,Jessika Rojas1,Sama Bilbao1,Mark Anderson2,Barret Elward2,Raul Rebak3
Virginia Commonwealth University1,University of Wisconsin–Madison2,General Electric3
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.05
Perovskite Alloys and Metal Halides at the Interface—Crystallographic Orientation and Environmental Degradation
Timothy Siegler1,Daniel Houck1,Yangning Zhang1,Mokshin Suri1,Brian Korgel1
University of Texas-Austin1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.06
Membrane Characterization Through Electrocompression
Joyce Beyrouthy1,Eric Freeman1
The University of Georgia1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.07
Generation of Shape-Tuned, Monodisperse Block Copolymer Particles Through Particle Restructuring by Solvent Engineering
Jae Man Shin1,Young Jun Lee1,Mingoo Kim1,Kang Hee Ku1,Junhyuk Lee1,YongJoo Kim1,Hongseok Yun1,Bumjoon Kim1
Korea Advanced Institute of Science and Technology1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.08
Surface Energy Measurements by Three Liquid Contact Angle Analysis Correlated with Ion Beam Analysis of Thin Silicon Oxides as a Function of Dopant Species and Concentration
Saaketh Narayan1,2,3,Jack Day1,2,3,Nikhil Suresh1,2,4,Nicole Herbots1,2,3,Robert Culbertson1,2
Arizona State University1,SiO2 Innovates, LLC2,AccuAngle Analytics, LLC3,MicroDrop Diagnostics, LLC4
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.09
Fabrication of High-Pressure-Phase α-PbO2-Type TiO2 Epitaxial Thin Films via Ultrahigh Pressure Treatment
Yuki Sasahara1,Hiroaki Asoma1,Koki Kanatani1,Kazunori Nishio1,Ryota Shimizu1,2,Norimasa Nishiyama1,Taro Hitosugi1
Tokyo Institute of Technology1,Japan Science and Technology Agency2
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.10
Transfer Printing of Colloidal Crystals Based on UVO Mediated Polymer Degradation
Rabibrata Mukherjee1
Indian Institute of Technology Kharagpur1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.11
Pyrolytic Carbon Films with Tunable Electronic Structure and Surface Functionality—A Planar Stand-in for Electroanalysis of Energy-Relevant Reactions
Jeffrey Long1,Jesse Ko1,Megan Sassin1,Joseph Parker1,Christopher Chervin1,Debra Rolison1
Naval Research Laboratory1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.12
Novel Utilization of Nano-Confinement Effect of Nanostructured Au—Surface-Bound Redox Cycling-Assisted Signal Amplification
Mijeong Kang1,Ho Sang Jung1,Sung-Gyu Park1,Dong-Ho Kim1
Korea Institute of Materials Science1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.13
Ordering and Miniaturization in Dewetting of Pre-Patterned Thin Polymer Films and Bilayers with Patterned Interface
Nandini Bhandaru1
Birla Institute of Technology and Science Pilani, Hyderabad Campus1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.14
Analysis of Deep Level and Oxide Interface Defects Using 100V HF Schottky Diodes and MOS CV’s for Silicon and 4H SiC HV MOSFETs, Advanced Power Electronics and RF ASIC
James Pan1
Northrop Grumman Electronic Systems1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.15
Surface Energy Modification of LiTaO3(100), LiNbO3(100), Si(100), and a-Quartz SiO2(100) for Low Temperature (
Brian Baker1,2,Jacob Kintz1,Aliya Yano1,Nicole Herbots1,2,3,Wey-Lyn Lee4,Saaketh Narayan1,2,3,Jack Day1,2,3,Yuko Akabane5,Robert Culbertson1
Arizona State University1,AccuAngle Analytics LLC2,SiO2 Innovates LLC3,Cactus Materials4,TDC Corporation5
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.16
Tensile Deformation Behavior and Inelastic Strain Recovery in Cu/Co Nanolaminates
Rohit Berlia1,Jagannathan Rajagopalan1
Arizona State University1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.17
Tunable Surface Area and Electrochemical Capacitance of Mn2O3 Nanofibers Through Controlled Calcination
Molly Brockway1,Jack Skinner1
Montana Technological University1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.18
Passivation and Positive Band-Edge Shift of Monocrystalline p-Silicon Through Surface Chemical Functionalization with Mixed Monolayers
Miguel Caban-Acevedo1,Bruce Brunschwig1,Nathan Lewis1
California Institute of Technology1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.19
A Comprehensive Study on Mechanical and Thermal Properties of HfSiO4—First-Principles Calculations and Experiments
Zhidong Ding1,Mackenzie Ridley1,Jeroen Deijkers1,Md Shafkat Bin Hoque1,John Gaskins1,Patrick Hopkins1,Haydn Wadley1,Elizabeth Opila1,Keivan Esfarjani1
University of Virginia1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.20
Molecular Interactions of Polydimethylsiloxane and Ni-Mn-Ga
Jaime Guevara Rojas1,Matthew Jones1,Eric Jankowski1,Peter Müllner1
Boise State University1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.21
Pinning Strength Quantification of Different Solute Concentrations at Grain Boundaries
David Jacobson1,2,Stephen Foiles2,Fadi Abdeljawad3,Gregory Thompson1
The University of Alabama1,Sandia National Laboratories2,Clemson University3
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.22
Atomistic Measurement of Energy of Ice Grain Boundary and the Ice-Metal Interface
Rigelesaiyin Ji1,Yipeng Peng1,Hang Li1,Liming Xiong1
Iowa State University of Science and Technology1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.23
Studies in the Crystallization Kinetics of Ultrathin Tungsten Oxide Layers
Michael Martinez-Szewczyk1,Chandler Cotton1,Sumner Harris1,Renato Camata1
University of Alabama at Birmingham1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.24
Investigation of Light Emission and Scattering Properties of a Racemic Mixture of Helicene Derivative Deposited on Plasmonic Substrates Using Scanning Tunneling Microscope (STM)
Pawel Krukowski1,2,Songpol Chaunchaiyakul1,Agung Setiadi1,Hideji Osuga3,Yuji Kuwahara1
Osaka University1,University of Lodz2,Wakayama University3
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.25
Mechanistic Understanding of Carburization from First-Principles Simulations
Ahmed Darwish1,Jacob Eapen1
North Carolina State University1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.26
Atomic Scale Study of Ordered-Structures Induced by Cu Grain Boundary Segregation at Al 7075 Alloys
Prakash Parajuli1,Ruben Mendoza-Cruz1,Miguel Yacaman1
University of Texas at San Antonio 1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.27
Controllable Introduction of Oxygenated Functional Groups into Carbon Materials for Gas Molecule Adsorption Enhancement
Xinxin Pi1,Ani Wang1,Zhibin Qu1,Fei Sun1,Jihui Gao1
Harbin Institute of Technology1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.28
Crystallinity Improvement of Mist Chemical Vapor Deposition Grown ZnO Thin Films by Controlling Film Crystal Orientation
Phimolphan Rutthongjan1,Misaki Nishi1,Li Liu1,Giang Dang1,Toshiyuki Kawaharamura1
Kochi University of Technology1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.29
Atomistic Modeling of Ionic Liquid Mixtures as Electrolytes in Electrochemical Capacitors
Alta Fang1,Alex Smolyanitsky1
National Institute of Standards and Technology1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.30
Ag Thin-Film Coating on LiCoO2 Electrodes for a Stable Solid-Electrolyte Interface at High-Voltage Operations
Taner Zerrin1,Cengiz Ozkan1,Mihrimah Ozkan1
University of California, Riverside1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.31
Molecular Dynamics Simulation and Disconnection Model for Faceting of Migrating Grain Boundaries
Larissa Woryk1,Spencer Thomas1,Jian Han1,Kongtao Chen1,David Srolovitz2,1
University of Pennsylvania1,City University of Hong Kong2
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.32
Thermotropic Polymers with Robust Interfaces for Transparency-Tunable and Impact-Resistant Windows
Cheng Zhang1,Jian Lin1
The University of Missouri1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.33
Multimodal Chemical and Functional Imaging of Functional Materials via Combined AFM/ToF-SIMS Platform
Anton Ievlev1
Oak Ridge National Laboratory1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.34
Off-Specular and Specular Neutron Reflection at Soft Interfaces—Probing Stability and Instability
Aljosa Hafner1,2,Philipp Gutfreund1,Boris Toperverg1,Andrew Wildes1,Andrew Jones2,Mark Geoghegan3,Michele Sferrazza2
Institut Laue - Langevin1,Université libre de Bruxelles2,The University of Sheffield3
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.35
Y-Sm-Doped Ceria Dense Dual–Phase Membranes for High–Temperature CO2 Separation
Daniela Gonzalez-Varela1,Oscar Ovalle-Encinia1,Heriberto Pfeiffer1
Universidad Nacional Autónoma de México1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.36
CO2 and CO Chemisorptions on Li2CuO2—Effect of Oxygen Addition
Ana Yañez-Aulestia1,Heriberto Pfeiffer1
Universidad Nacional Autónoma de México1
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.37
Using Light to Regulate Adhesion of Polymers to Substrate
Hossein Mostafavi1,Kyle Clark2,Miranda Sroda2,Javier Alaniz2,Chris Bardeen3
University of California, Riverside1,University of California, Santa Barbara2,University of California Riverside3
Show AbstractAbstracts will be available March 26.
5:00 PM - CP04.04.38
Shedding Light onto the Controversy Around Graphene Wettability Opacity by Locally Probing Surface Free Energy
Matteo Chiesa1,Jin-You Lu1
Khalifa University of Science and Technology1
Show AbstractAbstracts will be available March 26.
Symposium Organizers
Timothy Rupert, University of California, Irvine
Fadi Abdeljawad, Clemson
Julie Cairney, The University of Sydney
Jason Trelewicz, Stony Brook University
CP04.05: Interface Motion
Session Chairs
Srikanth Patala
Timothy Rupert
Wednesday AM, April 24, 2019
PCC West, 100 Level, Room 102 A
8:00 AM - CP04.05.01
Triple-Junction Dynamics During Grain Boundary Migration
David Srolovitz1,2,Spencer Thomas2,Jian Han2,Chaozhen Wei3,Yang Xiang3
City University of Hong Kong1,University of Pennsylvania2,The Hong Kong University of Science and Technology3
Show AbstractAbstracts will be available March 26.
8:30 AM - CP04.05.02
Shear Induced Motion of Twin Boundaries in Mg via Disconnection Terrace Nucleation, Growth and Coalescence
Douglas Spearot1,Laurent Capolungo2,Carlos Tome2
Univ of Florida1,Los Alamos National Laboratory2
Show AbstractAbstracts will be available March 26.
8:45 AM - CP04.05.03
The Thermal Behavior of Grain Boundaries Sampled by a Fast Atomistic Approach
Chuang Deng1,Tingting Yu2
University of Manitoba1,Nanjing University of Science and Technology2
Show AbstractAbstracts will be available March 26.
9:00 AM - CP04.05.04
A Machine Learning Exploration of Grain Boundary Mobility Mechanisms
Srikanth Patala1,Leila Khalili1,Eric Homer2
North Carolina State University1,Brigham Young University2
Show AbstractAbstracts will be available March 26.
CP04.06: Surface-Driven Phenomena
Session Chairs
Wednesday AM, April 24, 2019
PCC West, 100 Level, Room 102 A
10:00 AM - CP04.06.01
First Principle Study of the Protonation Effect and Active Sites Towards Oxygen Reduction Reaction on α-MnO2(211) Plane
Xuan Shi1,AM Kannan1,Xihong Peng1
Arizona State University1
Show AbstractAbstracts will be available March 26.
10:15 AM - CP04.06.02
"Good" and "Bad" Defects at Interfaces and Surfaces of Water Splitting Photoelectrodes
Artur Braun1,Yelin Hu1,2,Michael Graetzel2
Empa1,EPFL2
Show AbstractAbstracts will be available March 26.
10:30 AM - CP04.06.03
Time Resolved Ambient Pressure X-Ray Study of Li2CO3 Formation on Garnet Electrolyte in CO2
Meiling Sun1,2,Yierpan Aierken2,Ane Etxebarria1,3,Hao Shen1,David Prendergast2,Marca Doeff2,Ethan Crumlin1
Lawrence Berkeley Laboratory1,Lawrence Berkeley National Laboratory2,CIC Energigune, Parque Tecnológico de Álava3
Show AbstractAbstracts will be available March 26.
10:45 AM - CP04.06.04
Coupling Chemistry and Mechanics in Nanomaterials
Joerg Weissmueller1,2
Hamburg University of Technology1,Helmholtz-Center Geesthacht2
Show AbstractAbstracts will be available March 26.
11:15 AM - CP04.06.05
Tailoring the Strength of Nanoporous Gold by Self-Assembled Monolayers
Nadiia Mameka1,Lukas Lührs2,Stefan Heissler3,Hartmut Gliemann3,Christof Wöll3
Helmholtz-Zentrum Geesthacht1,Hamburg University of Technology2,Karlsruhe Institute of Technology3
Show AbstractAbstracts will be available March 26.
11:30 AM - CP04.06.06
Surface Dominated Deformation in Sub-10 nm Au Nanocrystals at High Pressure
Wendy Gu1,Abhinav Parakh1
Stanford University1
Show AbstractAbstracts will be available March 26.
11:45 AM - CP04.06.07
Multi-Resolution Characterization of Surface Topography for Improved Prediction of Surface Properties
Tevis Jacobs1,Abhijeet Gujrati1,Luke Thimons1,Subarna Khanal1,Lars Pastewka2
University of Pittsburgh1,University of Freiburg2
Show AbstractAbstracts will be available March 26.
CP04.07: Radiation and Interfaces
Session Chairs
Julie Cairney
Mitra Taheri
Wednesday PM, April 24, 2019
PCC West, 100 Level, Room 102 A
1:30 PM - CP04.07.01
Grain Boundary Metastability Under Irradiation—Toward Tunable Sink Efficiency
Mitra Taheri1
Drexel University1
Show AbstractAbstracts will be available March 26.
2:00 PM - CP04.07.02
Atomistic Multiscale Modeling of Compositional and Defect Dynamics for Ion Irradiation Synthesis of III-V Semiconductor Quantum Dots
Michael Lively1,Michael Toriyama1,Jean Paul Allain1
University of Illinois at Urbana-Champaign1
Show AbstractAbstracts will be available March 26.
2:15 PM - CP04.07.03
Atomic-Scale Mechanisms for Interfacial Radiation Damage Resistance of Oxide Heterostructures
Steven Spurgeon1,Michel Sassi1,Tiffany Kaspar1,Weilin Jiang1,Vaithiyalingam Shutthanandan1
Pacific Northwest National Laboratory1
Show AbstractAbstracts will be available March 26.
CP04.08: Characterizing Interfacial Chemistry
Session Chairs
Julie Cairney
Ann Chiaramonti-Debay
Wednesday PM, April 24, 2019
PCC West, 100 Level, Room 102 A
3:30 PM - CP04.08.01
Extreme Ultraviolet-Assisted Atom Probe Tomography
Ann Chiaramonti-Debay1,Luis Miaja-Avila1,Paul Blanchard1,David Diercks2,Brian Gorman2,Norman Sanford1
National Institute of Standards and Technology1,Colorado School of Mines2
Show AbstractAbstracts will be available March 26.
4:00 PM - CP04.08.02
Sub-Nanoscale Chemistry Across an Abrupt SiO2/Si Interface Using Vibrational Electron Energy-Loss Spectroscopy
Kartik Venkatraman1,Barnaby Levin1,Katia March1,Peter Rez1,Peter Crozier1
Arizona State University1
Show AbstractAbstracts will be available March 26.
4:15 PM - CP04.08.03
Interrogating the Atomic- and Nanoscale Interfacial Structure of Shear-Bands in a Low-Stacking Fault Energy Stainless Steel Using Advanced Scanning Transmission Electron Microscopy (STEM)
Julian Sabisch1,Doug Medlin1,Christopher San Marchi1,Joseph Ronevich1
Sandia National Laboratories1
Show AbstractAbstracts will be available March 26.
4:30 PM - CP04.08.04
Atomic-Scale Chemical Analysis at Ceramic Interfaces by Advanced Scanning Transmission Electron Microscopy
Naoya Shibata1
The University of Tokyo1
Show AbstractAbstracts will be available March 26.
Symposium Organizers
Timothy Rupert, University of California, Irvine
Fadi Abdeljawad, Clemson
Julie Cairney, The University of Sydney
Jason Trelewicz, Stony Brook University
CP04.09: Solid-Liquid Interfaces
Session Chairs
Fadi Abdeljawad
Jeffrey Hoyt
Thursday AM, April 25, 2019
PCC West, 100 Level, Room 102 A
8:00 AM - CP04.09.01
The Temperature Dependence of the Solid-Liquid Interfacial Free Energy in Cu-Zr and Al-Sm
Jeffrey Hoyt1,2,Lei Wang3,Sumathy Raman4,Ning Ma4,Mark Asta2
McMaster University1,University of California, Berkeley2,University of British Columbia3,ExxonMobil Research4
Show AbstractAbstracts will be available March 26.
8:30 AM - CP04.09.02
Gallium-Based Liquid Metal Wetting Behavior of Tungsten Powder Facilitated via Electroless Silver Coatings
Wilson Kong1,Matthew Ralphs1,Robert Wang1,Konrad Rykaczewski1
Arizona State University1
Show AbstractAbstracts will be available March 26.
8:45 AM - CP04.09.03
Transient Deformation Fields of Viscoelastic Substrates During Sessile Droplet Evaporation and Its Effect on Wettability
Julia Gerber1,Tobias Lendenmann1,Hadi Eghlidi1,Thomas Schutzius1,Dimos Poulikakos1
ETH Zürich1
Show AbstractAbstracts will be available March 26.
9:00 AM - CP04.09.04
Characterization of Chemically Heterogeneous Metal-Metal Solid-Liquid Interfaces Using Atomistic Simulation
Brian Laird1,Yang Yang2,J. Pablo Palafox-Hernandez3,Jesse Kern4,Mark Asta5
University of Kansas1,East China Normal University2,College of St. Scholastica3,Randolph College4,University of California, Berkeley5
Show AbstractAbstracts will be available March 26.
9:30 AM - CP04.09.05
Heterogeneous Ice Nucleation on Graphene and Plasma-Oxidized Silicon—Effects of Surface Energy and Topography
Cory Cline1,Jifeng Liu1,Tianshu Li2,Ulrike Wegst1
Dartmouth College1,George Washington University2
Show AbstractAbstracts will be available March 26.
9:45 AM - CP04.09.06
Adsorption Transparency of Supported Graphene to Water Molecules
Morteza Bagheri1,Rebecca Loibl1,Yingchun Jiang1,Anibal Boscoboinik2,Manuel Smeu1,Scott Schiffres1
Binghamton University, The State University of New York1,Brookhaven National Laboratory2
Show AbstractAbstracts will be available March 26.
CP04.10: Theoretical Advances in Modeling Boundary Evolution
Session Chairs
Fadi Abdeljawad
Nikolas Provatas
Thursday AM, April 25, 2019
PCC West, 100 Level, Room 102 A
10:30 AM - CP04.10.01
Interfacial Effects in Concentration-Driven Phase Change
Aashutosh Mistry1,Venkat Srinivasan2,Partha Mukherjee1
Purdue University1,Argonne National Laboratory2
Show AbstractAbstracts will be available March 26.
10:45 AM - CP04.10.02
Heterophase Interfacial Theory—Towards Atomic Level Phase Transformation Pathways in Light Alloys
Yiqiang Chen1,2,Nikhil Medhekar1,Laure Bourgeois1,3
Monash University1,Max-Planck-Institut für Eisenforschung2,Monash Centre for Electron Microscopy3
Show AbstractAbstracts will be available March 26.
11:00 AM - CP04.10.03
A Unified Phase Field Crystal Approach for Modeling Microstructure Evolution in Solidification Phenomena
Paul Jreidini1,Nikolas Provatas1
McGill University1
Show AbstractAbstracts will be available March 26.
11:30 AM - CP04.10.04
Diffusion Induced Grain Boundary Migration (DIGM) -A Molecular Dynamics Simulation
Navjot Kaur1,Chuang Deng1,Olanrewaju. A. Ojo1
University of Manitoba1
Show AbstractAbstracts will be available March 26.
11:45 AM - CP04.10.05
Interface Energy and Orientational Dependence of Interface Velocities and Mobilities of an Austenite-Ferrite Interface in Pure Fe Using Molecular Dynamics Simulation
Pawan Tripathi1,Somnath Bhowmick1
IIT Kanpur1
Show AbstractAbstracts will be available March 26.
CP04.11: Phase Transformations and Precipitation
Session Chairs
Thomas Britton
Jason Trelewicz
Thursday PM, April 25, 2019
PCC West, 100 Level, Room 102 A
1:30 PM - CP04.11.01
Hydrides and Deuterides in Zircaloy-4
Thomas Britton1,Siyang Wang1,Ruth Birch1,Vivian Tong1,Andrew Breen2,Isabelle Mouton2,Wenjun Lu2,Agnieszka Szczepaniak2,Paraskevas Kontis2,Leigh Stephenson2,Yanhong Chang2,Alisson Kwiatkowski da Silva2,Christian Liebscher2,Dierk Raabe2,Michael Herbig2,Baptiste Gault2,1,Finn Giuliani1
Imperial College London1,Max-Planck-Institut für Eisenforschung2
Show AbstractAbstracts will be available March 26.
2:00 PM - CP04.11.02
Mesoscale Modeling of Phase Transformations in Metal Hydrides for Hydrogen Storage
Tae Wook Heo1,Xiaowang Zhou2,ShinYoung Kang1,Rongpei Shi1,Brandon Wood1
Lawrence Livermore National Laboratory1,Sandia National Laboratories2
Show AbstractAbstracts will be available March 26.
2:15 PM - CP04.11.03
Energetics and Mechanism of the Metal-Induced Crystallization of Amorphous Carbon Thin Films
Daniel Janke1,Robert Wenisch1,René Huebner1,Joerg Grenzer1,Sibylle Gemming1,2,David Rafaja3,Matthias Krause1
Helmholtz-Zentrum Dresden-Rossendorf1,Technische Universität Chemnitz2,Technische Universität Bergakademie Freiberg3
Show AbstractAbstracts will be available March 26.
2:30 PM - CP04.11.04
Segregation and Precipitation at Grain or Phase Boundaries of a Duplex Stainless Steel and a Ni-Based Super-Alloy
Gang Sha1
Nanjing University of Science and Technology1
Show AbstractAbstracts will be available March 26.
CP04.12: Oxide Interfaces
Session Chairs
Emmanuelle Marquis
Jason Trelewicz
Thursday PM, April 25, 2019
PCC West, 100 Level, Room 102 A
3:30 PM - CP04.12.01
Oxide Scale Evolution on Ni and Ti Alloys
Emmanuelle Marquis1,Talia Barth1,Paul Chao1,Kathleen Chou1,Emmanuelle Marquis1
University of Michigan1
Show AbstractAbstracts will be available March 26.
4:00 PM - CP04.12.02
Morphological Stability and Breakdown of Passive Oxide Films
Rohit Ramanathan1,Peter Voorhees1
Northwestern University1
Show AbstractAbstracts will be available March 26.
4:15 PM - CP04.12.03
Ab Initio Prediction of Metastable Phases at Metal/Oxide Heterointerfaces
Aakash Kumar1,Amit Sharma2,Eugen Rabkin2,David Srolovitz1,3
University of Pennsylvania1,Technion–Israel Institute of Technology2,City University of Hong Kong3
Show AbstractAbstracts will be available March 26.
4:30 PM - CP04.12.04
Crystallization of Complex Oxides in Proximity of Semiconductor Surfaces with Non-Planar Geometries
Divya Prakash1,Yajin Chen2,Christoph Deneke3,Paul Evans2,Francesca Cavallo1
The University of New Mexico1,University of Wisconsin–Madison2,Universidade Estadual de Campinas3
Show AbstractAbstracts will be available March 26.
Symposium Organizers
Timothy Rupert, University of California, Irvine
Fadi Abdeljawad, Clemson
Julie Cairney, The University of Sydney
Jason Trelewicz, Stony Brook University
CP04.13: Properties and Evolution of Polycrystals
Session Chairs
Andrea Hodge
Timothy Rupert
Friday AM, April 26, 2019
PCC North, 100 Level, Room 121 B
8:00 AM - CP04.13.01
Development of Synthesis Method to Control Grain Size, Dispersion and Phase Composition of Thin Films
Paul Rasmussen1,Jagannathan Rajagopalan1,Rohit Sarkar1
Arizona State University1
Show AbstractAbstracts will be available March 26.
8:15 AM - CP04.13.02
Effects of Case Hardening Treatments on the Microstructure and Properties of Stainless Steel 316L
Gwénaëlle Proust1,D. Retraint2,D, Gallitelli2,M. Chemkhi3,C. Demangel4
University of Sidney1,University of Technology of Troyes, ICD/LASMIS2,EPF3,CRITT-MDTS4
Show AbstractAbstracts will be available March 26.
8:45 AM - CP04.13.03
Interfacial Solute Segregation Behavior in Nanocrystalline Stabilized Alloys
Gregory Thompson1,Xuyang Zhou1,Ankit Gupta2,Thomas R. Koenig1,Garritt J. Tucker2
Univ of Alabama1,Colorado School of Mines2
Show AbstractAbstracts will be available March 26.
9:00 AM - CP04.13.04
Thermal Processes and Mechanisms in Sputtered Nanostructures
Andrea Hodge1
University of Southern California1
Show AbstractAbstracts will be available March 26.
9:30 AM - CP04.13.05
An Investigation into the Deformation Behavior of High Oxygen-Doped CP-Ti Under Quasi-Static and Dynamic Loading
Wendi Shi1,Jianghua Shen1,Junko Umeda2,Katsuyoshi Kondoh2,Yulong Li1
Northwestern Polytechnical University1,Osaka University2
Show AbstractAbstracts will be available March 26.
9:45 AM - CP04.13.06
Mesoscale Crystal Plasticity Modeling of Buckling Behavior of Nanoscale Al-Al2Cu Eutectic Alloy
Guisen Liu1,Shujuan Wang2,Amit Misra2,Jian Wang1
University of Nebraska–Lincoln1,University of Michigan2
Show AbstractAbstracts will be available March 26.
CP04.14: Deformation at Interfaces
Session Chairs
Shen Dillon
Timothy Rupert
Friday AM, April 26, 2019
PCC North, 100 Level, Room 121 B
10:30 AM - CP04.14.01
Oxide Grain Boundary Deformation and Failure Characterized by In Situ TEM
Shen Dillon1
University of Illinois1
Show AbstractAbstracts will be available March 26.
11:00 AM - CP04.14.02
Microcrack—Interface Interactions in Ferrous Martensite
Hyunseok Oh1,Jiyun Kang1,C. Cem Tasan1
Massachusetts Institute of Technology1
Show AbstractAbstracts will be available March 26.
11:15 AM - CP04.14.03
Quantifying the Coupled Dynamics Between Dislocations and STZ in Amorphous-Crystalline Metallic Composites Through Atomistic Simulations
Thanh Phan1,Rigelesaiyin Ji1,Liming Xiong1
Iowa State University1
Show AbstractAbstracts will be available March 26.
11:30 AM - CP04.14.04
Mechanically Interface Energies that Capture Dislocation Transmission
Katerina Aifantis1,Bryan Kuhr1
Univ of Florida1
Show AbstractAbstracts will be available March 26.
CP04.15: Twin Boundaries and Stacking Faults
Session Chairs
Friday PM, April 26, 2019
PCC North, 100 Level, Room 121 B
1:30 PM - CP04.15.01
Twinning in Multiple Principal Element Alloys—Atomistic Simulation Studies
Mark Asta2,1,Jun Ding1,Robert Ritchie1,2
Lawrence Berkeley National Laboratory1,University of California, Berkeley2
Show AbstractAbstracts will be available March 26.
2:00 PM - CP04.15.02
Atomistic Level Mechanism for the Formation of Long Period Stacking Order (LPSO) in Magnesium Alloys
Yiqiang Chen1,Huan Zhao1,Blazej Grabowski1,Jing Su1,Christian Liebscher1,Baptiste Gault1,Dierk Raabe1
Max-Planck-Institut für Eisenforschung1
Show AbstractAbstracts will be available March 26.
2:15 PM - CP04.15.03
On the Different Relaxation Schemes During Generalized Stacking Fault Energy Analysis in Hexagonal Close-Packed Metals—A Case Study of Magnesium
George Voyiadjis1,Reza Namakian1
Louisiana State University1
Show AbstractAbstracts will be available March 26.
2:30 PM - CP04.15.04
The Role of Twin Boundaries on Failure Mechanisms in Nickel-Based Superalloys
Zhenbo Zhang1,Yiqiang Chen2,Michael Preuss1
University of Manchester1,Max-Planck-Institut für Eisenforschung2
Show AbstractAbstracts will be available March 26.
2:45 PM - CP04.15.05
Preferential Intergranular Corrosion Along Coherent Twin Boundaries in Pure Ni
Mengying Liu1,Matteo Seita2,Michael Demkowicz1
Texas A&M University1,Nanyang Technological University2
Show AbstractAbstracts will be available March 26.
CP04.16: Property Control Through Grain Boundary Segregation
Session Chairs
William Bowman
Julie Cairney
Friday PM, April 26, 2019
PCC North, 100 Level, Room 121 B
3:30 PM - CP04.16.01
Nano-Scale Effects on Grain Growth—Grain Boundary Energy and Velocity in Magnesium Aluminate
Ricardo Castro1,Derek Muche1
University of California, Davis1
Show AbstractAbstracts will be available March 26.
4:00 PM - CP04.16.02
Enhancing Grain Boundary Ionic Conductivity in Ceramics via Local Solute Enrichment and a New Data-Driven Interacting-Defect Model Describing Nanoscopic Interface Compositions
William Bowman1,Xiaorui Tong2,David Mebane2,Peter Crozier3
Massachusetts Institute of Technology1,West Virginia University2,Arizona State University3
Show AbstractAbstracts will be available March 26.
4:15 PM - CP04.16.03
Atomistic Studies of Effects of Alloying Element Segregation on Grain Boundary Cohesive Strength in Fe-Based Alloys
Axel Alcocer Seoane1,Xian-Ming Bai1
Department of Materials Science and Engineering, Virginia Polytechnic Institute and State University1
Show AbstractAbstracts will be available March 26.
4:30 PM - CP04.16.04
First-Principles Studies of Effects of Oxygen Impurity on Grain Boundary Strength in Nickel
Ziqi Xiao1,Xian-Ming Bai1
Virginia Polytechnic Institute and State University1
Show AbstractAbstracts will be available March 26.
4:45 PM - CP04.16.05
Understanding the Role of High-Solute Grain Boundary Composition and Local Atomic Structure for Improved Ionic Conductivity in CeO2 Ceramic Oxides
Tara Boland1,Peter Rez1,Peter Crozier1
Arizona State University1
Show AbstractAbstracts will be available March 26.