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Meeting MS&T23: Materials Science & Technology
Symposium Synthesis, Characterization, Modeling and Applications of Functional Porous Materials
Presentation Title Structure and Sorption Properties of Nickel-3-Amino-Isonicotinate (Ni-NH2-INA), a Microporous Material for CO2 Capture Application
Author(s) Winnie K. Wong-Ng, Jeffrey Culp, Yu-Sheng Chen, Peter Zavalij, Daniel Siderius, Tieyan Chang, Mingjian Zhang
On-Site Speaker (Planned) Winnie K. Wong-Ng
Abstract Scope Crystal structure of the microporous compound, Nickel-3-amino-isonicotinate (Ni-NH2-INA) was investigated using the Microdiffraction Facility of ChemMatCARS at the Advanced Photo Source (APS). The structure with solvent of crystallization, tetrahydrofuran (THF), was determined to be orthorhombic, space group Pnn2, a=12.089(3) Å, b=6.91331(2) Å, c=10.5056(3) Å, V=2878.01(4) Å3, Z=2, and Dc=1.532 gcm-1. The nickel sites are 6-fold coordinated, each nickel is bonded to four oxygens from two carboxylate groups, and to two N sites of the pyridine groups. The rigid 3D connected network depicts a pseudo-square shaped pore channel with disordered THF, and the Ni sites form the corners (anchors) of these pores. This material including the entrapped solvent can be described with a chemical formula C16H18N4NiO5. The CO2 sorption curves of evacuated Ni-NH2-INA show a type-I behavior. Further structure studies of Ni-NH2-INA using in situ X-ray technique as a function of pCO2 at APS were conducted and results will be discussed.

OTHER PAPERS PLANNED FOR THIS SYMPOSIUM

Accelerating Development of Porous Sorbents for Direct Air Capture Using High Throughput Computing and Machine Learning
CO2 Conversion Catalyzed by Open Metal Sites in Porous Framework Materials
Density Functional Theory Studies of the Carbonation of Portlandite and Brucite
Development of Low-cost Nanoporous Ceramic Composite Membranes for Micro/Ultra-filtration
Direct Conversion of the Captured CO2 into Valuable Products Using CO2 Transport Membrane Reactor
Fabricating Nitinol Microtubes via Gas-phase Alloying: A Computational and Experimental Feasibility Study
Facile Synthesis, Structural and Catalytic Performances of the Porous Carbon Foam Composites Containing Carbon Nanotubes and Graphene Oxide as Reinforcements
High-throughput, Ultra-fast Laser Sintering of Ceramics and Machine-learning Based Prediction on Processing-Microstructure-Property Relationships
Implications of Nanoscale Amorphous Metal Oxide Electrode Materials for Lithium Ion Batteries
Neutron and X-ray Scattering Measurements of Materials for Hydrogen Storage
Novel Method for Continuous Production of Coal-derived Carbon Foam
Optimized Porous Superhydrophobic Coating to Prevent Carbon Steel Corrosion
Porosity at the Molecular Level in C60 Fullerene-based Structures
Powder Design for Additive Manufacturing of Porous Metals
Preparation of Porous Catalytic Intermetallic Alloys Under Conditions of Synthesis of Complex Functionally Active Charges
Selective Lithium Extraction from Brines and Production Of Battery-Grade LiOH Using Porous H2TiO3 Ion Sieve Adsorbents Integrated with Electrodialysis
Structure and Sorption Properties of Nickel-3-Amino-Isonicotinate (Ni-NH2-INA), a Microporous Material for CO2 Capture Application
Synergizing Structural and Functional Hierarchy in Porous Catalysts and Sensors for Mitigation of Aqueous Pollutants.
Thermodynamic Stability of Boron Imidazolate Frameworks (BIFs) Synthesized by Mechanochemistry
Uncovering Structure-property Relationships in Complex, Inhomogeneous Materials: High-throughput Calculation of Stochastic Materials
Utilizing, Tuning, and Modeling Adsorption in Flexible MOFs for Improved Separation of Binary Mixtures

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