Accelerated Discovery and Development of Inorganic Materials | AIChE

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Accelerated Discovery and Development of Inorganic Materials

Chair(s)

Nair, S., Georgia Institute of Technology

Co-chair(s)

Kim, S., Oklahoma State University
Liu, D., University of Maryland

This session targets the increasing work on high-throughput computational/experimental screening, selection, evaluation, and genomics of inorganic materials.

Presentations

3:15 PM
(388a) High Throughput Analysis of Alloy Corrosion Across Composition Space: AlxFeyNi1-X-Y (x = 0 → 1, y = 0 → 1-x)
3:33 PM
(388b) A Novel Route to Phase Diagrams: Recovering 0 Kelvin Hamiltonian Parameters from High-Temperature Disordered Phases
3:51 PM
(388c) High-Throughput Prediction of Finite Temperature Free Energies of Solids
4:09 PM
(388d) First-Principles Based Design of Low Tolerance Factor Perovskites
4:27 PM
(388e) Descriptors and Approaches for Characterization and Screening of Inorganic Materials Databases
4:45 PM
(388f) Towards More Complete Energy Landscapes of Zeolites: The Energetics of Zeolites with Comprehensive Ranges of Framework Topologies and Different Substituting Tetrahedral Atoms
5:03 PM
(388g) Compilation and Analysis of the Computation-Ready, Experimental Metal-Organic Frameworks: Core MOF Version 2.0
5:21 PM
(388h) Synthesis of MOF-74(Ni) Using Segmented-Flow and Microwave-Assisted Methods with Chemical Modulation

Topics 

Materials
Nanotechnology
Nanoscale Engineering

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Individuals

AIChE Pro Members $150.00
AIChE Graduate Student Members Free
AIChE Undergraduate Student Members Free
AIChE Explorer Members $225.00
Non-Members $225.00

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