Research Output per year
Research Output per year
Personal profile
Research interests
We, as a research team, are involved in various projects on molecular dynamics simulations of ionic liquids and deep eutectic solvents to explore the underlying interactions of/within these solvents, and to correlate these interactions to their thermophysical and chemical properties. In addition, we also performs molecular/quantum simulations on biomolecules to understand and enhance their structural stability. The buzz words for our works are
- Molecular dynamics simulations
- Ionic liquids, Deep eutectic solvents
- Adsorption over nanomaterials
- Protein aggregation and bio-molecular stability
- Aerosol Chemistry
Personal profile
Dr. Dhawal Shah is an assistant professor in the department of Chemical and Materials Engineering at Nazarbayev University (NU) since August 2015. He received his B. Tech. degree in Chemical Engineering from Indian Institute of Technology, Roorkee and Ph. D. degree in Chemical and Pharmaceutical Engineering from Singapore-MIT Alliance at National University of Singapore. Prior to joining NU, he has been working as lecturer and assistant professor at Middle East Technical University in Cyprus and in Sultan Qaboos University, Oman, respectively.
Teaching
- Thermodynamics (Graduate; Undergraduate)
- Chemical Plant Design and Optimization (Undergraduate)
- Chemical Process Calculations (Undergraduate)
- Computer Aided Design (Aspen Plus; Undergraduate)
- Heat Transfer and Exchanger Design (Undergraduate)
- Physical Chemistry (Undergraduate)
- Process Control and Dynamics (Undergraduate)
- Occupational and Environmental Health and Safety (Undergraduate)
- Engineering Economics (Undergraduate)
- Surface and Colloid Sciences (Graduate; Undergraduate)
- Plant Economics and Design (Graduate)
- Resource Engineering (Includes Green Engineering, Biotechnology) (Graduate; Undergraduate)
- Unit Operation Laboratories (Undergraduate)
- Fluid Mechanics (Undergraduate)
Research interests
We, as a research team, are involved in various projects on molecular dynamics simulations of ionic liquids and deep eutectic solvents to explore the underlying interactions of/within these solvents, and to correlate these interactions to their thermophysical and chemical properties. In addition, we also performs molecular/quantum simulations on biomolecules to understand and enhance their structural stability. The buzz words for our works are
- Molecular dynamics simulations
- Ionic liquids, Deep eutectic solvents
- Adsorption over nanomaterials
- Protein aggregation and bio-molecular stability
- Aerosol Chemistry
Personal profile
Dr. Dhawal Shah is an assistant professor in the department of Chemical and Materials Engineering at Nazarbayev University (NU) since August 2015. He received his B. Tech. degree in Chemical Engineering from Indian Institute of Technology, Roorkee and Ph. D. degree in Chemical and Pharmaceutical Engineering from Singapore-MIT Alliance at National University of Singapore. Prior to joining NU, he has been working as lecturer and assistant professor at Middle East Technical University in Cyprus and in Sultan Qaboos University, Oman, respectively.
Teaching
- Thermodynamics (Graduate; Undergraduate)
- Chemical Plant Design and Optimization (Undergraduate)
- Chemical Process Calculations (Undergraduate)
- Computer Aided Design (Aspen Plus; Undergraduate)
- Heat Transfer and Exchanger Design (Undergraduate)
- Physical Chemistry (Undergraduate)
- Process Control and Dynamics (Undergraduate)
- Occupational and Environmental Health and Safety (Undergraduate)
- Engineering Economics (Undergraduate)
- Surface and Colloid Sciences (Graduate; Undergraduate)
- Plant Economics and Design (Graduate)
- Resource Engineering (Includes Green Engineering, Biotechnology) (Graduate; Undergraduate)
- Unit Operation Laboratories (Undergraduate)
- Fluid Mechanics (Undergraduate)
Education/Academic qualification
Chemical Engineering, Ph.D., National University of Singapore
Award Date: Jul 1 2011
External positions
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Research Output
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Comprehensive Computational Analysis Exploring the Formation of Caprolactam-Based Deep Eutectic Solvents and Their Applications in Natural Gas Desulfurization
Karibayev, M. & Shah, D., Aug 20 2020, In : Energy and Fuels. 34, 8, p. 9894-9902 9 p.Research output: Contribution to journal › Article › peer-review
1 Citation (Scopus) -
Exposure to particulate matter and gaseous pollutants during cab commuting in Nur-Sultan city of Kazakhstan
Amouei Torkmahalleh, M., Hopke, P. K., Broomandi, P., Naseri, M., Abdrakhmanov, T., Ishanov, A., Kim, J., Shah, D. & Kumar, P., May 2020, In : Atmospheric Pollution Research. 11, 5, p. 880-885 6 p.Research output: Contribution to journal › Article › peer-review
4 Citations (Scopus) -
Impact of volatile organic compounds on chromium containing atmospheric particulate: insights from molecular dynamics simulations
Shah, D., Karibayev, M., Adotey, E. K. & Amouei Torkmahalleh, M., Dec 1 2020, In : Scientific Reports. 10, 1, 17387.Research output: Contribution to journal › Article › peer-review
Open Access -
Molecular Dynamics Simulations to Capture Nucleation and Growth of Particulates in Ethanolamine-Based Post-Combustion CO2 Capture Columns
Shah, D., Saparov, A., Mansurov, U. & Amouei Torkmahalleh, M., Feb 19 2020, In : Industrial and Engineering Chemistry Research. 59, 7, p. 3213-3220 8 p.Research output: Contribution to journal › Article › peer-review
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Monoethanolamine based DESs for CO2 absorption: Insights from molecular dynamics simulations
Kussainova, D. & Shah, D., Jan 16 2020, In : Separation and Purification Technology. 231, 115931.Research output: Contribution to journal › Article › peer-review
8 Citations (Scopus)