talks
Conferences presentations and Posters
Oral presentations
- Opportunities in Semiconductor industries. Professional Skills Development course, Rutgers University. Oct 14, 2024.
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Hybrid MD/MC Simulations of Adsorption on Flexible Nanoporous Materials. AIChE Annual Meeting, Orlando, Nov 9, 2023.
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Understanding the Origins of Reversible and Hysteretic Pathways of Adsorption Phase Transitions by Mesocanonical Ensemble Monte Carlo Simulations. Characterization of Porous Materials (CPM)-9, May 20, 2024.
- Analyzing Material Flexibility for CO2 Storage: A Molecular Modeling Approach. CBE-GSO Fall Research Forum, Nov 28, 2023.
- Mesocanonical Ensemble Simulations to Model Adsorption Phase Transitions within Nanopores. AIChE Annual Meeting, Orlando, Nov 9, 2023.
- Modeling Kerogen Flexibility upon Gas Adsorption Using Osmotic Ensemble Simulations. AIChE Annual Meeting, Orlando, Nov 7, 2023.
- Machine Learning Approach for Construction of Fingerprint Kernels for Pore Structure Characterization of Metal-Organic Frameworks. AIChE Annual Meeting, Phoenix, Nov 16, 2022.
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Adsorption based Pore Structure Characterization of Kerogen Fractions of Shales. Fundamental of Adsorption Conference, Denver- Co, May 24, 2022.
- Monte Carlo and Density Functional Theory for Pore Structure Characterization of Kerogen. 3rd Molecular Simulations Workshop- NJIT, May 10, 2022.
- Advanced Pore Structure Characterization of Crystalline and Amorphous Materials. Webinar at University of Laval, Feb 04, 2022. Invited Speaker
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Molecular Modeling and Adsorption Characterization of Micro- Mesoporous Kerogen Nanostructures. AIChE Annual Meeting, Boston- MA, Nov 10, 2021.
- Revealing Specifics of Gas Adsorption in Metal-Organic Frameworks from Compartmentalization of Isotherms. AIChE Annual Meeting, Boston- MA, Nov 08, 2021.
- Pore Level Compartmentalization of Adsorption Isotherms as a Rationale for Pore structure characterization of Metal-Organic Frameworks. International Adsorption Society Invited Webinar, Aug 17, 2021. Invited Speaker
- Decomposition of Adsorption Isotherms to characterize Metal-Organic Frameworks. AIChE Annual Meeting, San Francisco- CA, Nov 16, 2020.
Poster presentations
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PyCOSMOS: A Python Tool for Compartmentalization of Unit Cells of Metal-Organic Frameworks. Characterization of Porous Materials (CPM)-9, May 21, 2024. Best poster award
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Modeling Kerogen Flexibility in Response to Hydrocarbon Adsorption using Hybrid Molecular Dynamics/Monte Carlo. Characterization of Porous Materials (CPM)-9, May 21, 2024.
- Modeling Gas Adsorption within Nanopores using Mesocanonical Ensemble Simulations. 4th Molecular Simulations workshop- NJIT, May 30, 2023.
- Pore Level Decomposition of Adsorption Isotherms in Metal-Organic Frameworks. IAS Twitter Conference, Dec 7-11, 2020. Best poster award
- Decomposition of Adsorption Isotherms with respect to pore type in Metal-Organic Frameworks. MolSim, Amsterdam- NL, Jan 9, 2020.
- Segregation of Non-Spherical Granular Particles in a Rotating Cylinder. ACS on Campus, Indian Institute of Technology Roorkee, Feb 7, 2018. Best poster award