High-throughput computational prediction of the cost of carbon capture using mixed matrix membranes S Budhathoki, O Ajayi, JA Steckel, CE Wilmer Energy & Environmental Science 12 (4), 1255-1264, 2019 | 77 | 2019 |
Combined application of high-field diffusion NMR and molecular dynamics simulations to study dynamics in a mixture of carbon dioxide and an imidazolium-based ionic liquid ED Hazelbaker, S Budhathoki, A Katihar, JK Shah, EJ Maginn, ... The Journal of Physical Chemistry B 116 (30), 9141-9151, 2012 | 55 | 2012 |
Molecular Simulation Study of the Solubility, Diffusivity and Permselectivity of Pure and Binary Mixtures of CO2 and CH4 in the Ionic Liquid 1-n-Butyl-3 … S Budhathoki, JK Shah, EJ Maginn Industrial & Engineering Chemistry Research 54 (35), 8821-8828, 2015 | 41 | 2015 |
Molecular simulation study of the performance of supported ionic liquid phase materials for the separation of carbon dioxide from methane and hydrogen S Budhathoki, JK Shah, EJ Maginn Industrial & Engineering Chemistry Research 56 (23), 6775-6784, 2017 | 40 | 2017 |
Molecular design and fabrication of PIM-1/polyphosphazene blend membranes with high performance for CO2/N2 separation AK Sekizkardes, S Budhathoki, L Zhu, V Kusuma, Z Tong, JS McNally, ... Journal of Membrane Science 640, 119764, 2021 | 23 | 2021 |
Amine-functionalized porous organic polymers for carbon dioxide capture AK Sekizkardes, P Wang, J Hoffman, S Budhathoki, D Hopkinson Materials Advances 3 (17), 6668-6686, 2022 | 22 | 2022 |
Relationship between diffusion and chemical exchange in mixtures of carbon dioxide and an amine-functionalized ionic liquid by high field NMR and kinetic Monte Carlo simulations ED Hazelbaker, S Budhathoki, H Wang, J Shah, EJ Maginn, S Vasenkov The Journal of Physical Chemistry Letters 5 (10), 1766-1770, 2014 | 8 | 2014 |
Job satisfaction of nurses in Western region of Nepal J Shah, AB Hamal, G Hamal, M Shah, SS Budhathoki Nurse Health Care 11 (3), 45-55, 2019 | 7 | 2019 |
Creation of Polymer Datasets with Targeted Backbones for Screening of Gas Permeability and Selectivity SP Tiwari, W Shi, S Budhathoki, J Baker, D Hopkinson, J Steckel | 1 | 2023 |
Molecular modeling and simulation study of the structure and dynamics of confined ionic liquids and their performance in gas separations S Budhathoki University of Notre Dame, 2016 | 1 | 2016 |
Creation of Polymer Datasets with Targeted Backbones for Screening of High-Performance Membranes for Gas Separation SP Tiwari, W Shi, S Budhathoki, J Baker, AK Sekizkardes, L Zhu, ... Journal of Chemical Information and Modeling, 2024 | | 2024 |
Computational Modeling of Metal Organic Frameworks for Carbon Capture S Budhathoki, J Findley, C Martin, T Baucom National Energy Technology Laboratory (NETL), Pittsburgh, PA, Morgantown, WV …, 2023 | | 2023 |
Effect of Flexibility in Molecular Simulations of Carbon Dioxide Adsorption and Diffusion in a Cuprous Triazolate Framework T Baucom, S Budhathoki, JA Steckel The Journal of Physical Chemistry C 127 (35), 17524-17531, 2023 | | 2023 |
CO2 Adsorption Enhancement of MOF-808 via Highly Efficient Amine Incorporation P Muldoon, S Budhathoki, C Wilmer, D Sorescu, J Steckel National Energy Technology Laboratory (NETL), Pittsburgh, PA, Morgantown, WV …, 2023 | | 2023 |
Computational Evaluation of Flexible Metal-Organic Frameworks for Capture J Findley, S Budhathoki, J Steckel National Energy Technology Laboratory (NETL), Pittsburgh, PA, Morgantown, WV …, 2023 | | 2023 |
Creation of Polymer Datasets for Screening of Gas Permeability and Selectivity S Tiwari, W Shi, S Budhathoki, J Baker, J Steckel, D Hopkinson National Energy Technology Laboratory (NETL), Pittsburgh, PA, Morgantown, WV …, 2023 | | 2023 |
Computationally-Aided Design of Amine-Grafted MOFs for Direct Air Capture P Muldoon, S Budhathoki, C Wilmer, D Sorescu, J Steckel National Energy Technology Laboratory (NETL), Pittsburgh, PA, Morgantown, WV …, 2022 | | 2022 |
Computational Screening of Metal Organic Frameworks (MOFS) for Carbon Capture S Budhathoki, C Wilmer, J Steckel National Energy Technology Laboratory (NETL), Pittsburgh, PA, Morgantown, WV …, 2022 | | 2022 |
Computational Screening of MOFs for Carbon Capture CEW Samir Budhathoki, Janice A. Steckel Carbon management meting, 2022 | | 2022 |
Systematic Chem-Informatics and Machine Learning Studies for Gas Permeability and Selectivity in Polymers W Shi, S Tiwari, S Budhathoki, JA Steckel, A Sekizkardes, L Zhu, S Yi, ... 2021 AIChE Annual Meeting, 2021 | | 2021 |