Molecular dynamics simulations of water confined in calcite slit pores: an NMR spin relaxation and hydrogen bond analysis SM Mutisya, A Kirch, JM De Almeida, VM Sanchez, CR Miranda The Journal of Physical Chemistry C 121 (12), 6674-6684, 2017 | 47 | 2017 |
Fresh molecular look at calcite–brine nanoconfined interfaces A Kirch, SM Mutisya, VM Sánchez, JM De Almeida, CR Miranda The Journal of Physical Chemistry C 122 (11), 6117-6127, 2018 | 29 | 2018 |
Brine–oil interfacial tension modeling: Assessment of machine learning techniques combined with molecular dynamics A Kirch, YM Celaschi, JM de Almeida, CR Miranda ACS applied materials & interfaces 12 (13), 15837-15843, 2020 | 22 | 2020 |
CO2 Adsorption Enhanced by Tuning the Layer Charge in a Clay Mineral KW Bø Hunvik, P Loch, D Wallacher, A Kirch, LP Cavalcanti, M Rieß, ... Langmuir 37 (49), 14491-14499, 2021 | 15 | 2021 |
CO2 Capture by Nickel Hydroxide Interstratified in the Nanolayered Space of a Synthetic Clay Mineral KWB Hunvik, P Loch, LP Cavalcanti, KK Seljelid, PM Røren, S Rudić, ... The Journal of Physical Chemistry C 124 (48), 26222-26231, 2020 | 14 | 2020 |
Efficient CH4/CO2 Gas Mixture Separation through Nanoporous Graphene Membrane Designs N Razmara, A Kirch, JR Meneghini, CR Miranda Energies 14 (9), 2488, 2021 | 8 | 2021 |
Influence of CO2 on Nanoconfined Water in a Clay Mineral KWB Hunvik, RJS Lima, A Kirch, P Loch, P Monceyron Røren, ... The Journal of Physical Chemistry C 126 (40), 17243-17254, 2022 | 7 | 2022 |
Multiscale molecular modeling applied to the upstream oil & gas industry challenges A Kirch, N Razmara, VFS Mamani, JR Meneghini, CR Miranda Polytechnica 3, 54-65, 2020 | 7 | 2020 |
Multilevel molecular modeling approach for a rational design of ionic current sensors for nanofluidics A Kirch, JM de Almeida, CR Miranda Journal of chemical theory and computation 14 (6), 3113-3120, 2018 | 6 | 2018 |
Intercalation of CO2 Selected by Type of Interlayer Cation in Dried Synthetic Hectorite KWB Hunvik, KK Seljelid, D Wallacher, A Kirch, LP Cavalcanti, P Loch, ... Langmuir 39 (14), 4895-4903, 2023 | 5 | 2023 |
Large bandgap insulating superior clay nanosheets B Pacakova, PE Vullum, A Kirch, J Breu, CR Miranda, JO Fossum MRS Bulletin 47 (12), 1198-1203, 2022 | 5 | 2022 |
Flow through deformed carbon nanotubes predicted by rigid and flexible water models BHS Mendonça, EE de Moraes, A Kirch, RJC Batista, AB de Oliveira, ... The Journal of Physical Chemistry B 127 (40), 8634-8643, 2023 | 2 | 2023 |
Revisiting greenhouse gases adsorption in carbon nanostructures: advances through a combined first-principles and molecular simulation approach HM Cezar, TD Lanna, DA Damasceno, A Kirch, CR Miranda arXiv preprint arXiv:2307.11710, 2023 | 2 | 2023 |
Propriedades eletrônicas em nanossistemas baseados em nanotubos de carbono e grafeno A Kirch Universidade de São Paulo, 2014 | 2 | 2014 |
Computational design of nanostructures and nanofluidic Systems D Damasceno, A Kirch, R Rodriguez, R Sanches, J Meneghini, C Miranda, ... Bulletin of the American Physical Society, 2023 | | 2023 |
Mechanical and adsorption properties of greenhouse gases filled carbon nanotubes DA Damasceno, HM Cezar, TD Lanna, A Kirch, CR Miranda arXiv preprint arXiv:2307.11708, 2023 | | 2023 |
Revisiting greenhouse gases adsorption in carbon nanostructures: advances through a combined first-principles and molecular simulation approach H Musseli Cezar, T Duarte Lanna, DA Damasceno, A Kirch, ... arXiv e-prints, arXiv: 2307.11710, 2023 | | 2023 |
Unraveling fluid-fluid interfaces through molecular simulations and machine learning DN Lin, A Kirch, CR Miranda 2022 Goldschmidt Conference, 2022 | | 2022 |
First principles characterization of the interlayer electrostatic environment influencing the CO2 geochemical trapping in clays A Kirch, CR Miranda Goldschmidt2021• Virtual• 4-9 July, 2021 | | 2021 |
Nanoscale Study of CO2/CH4 Separation through Two-stage Nanoporous Graphene Membranes N Razmara, A Kirch, D Andrade Damasceno, J Romano Meneghini, ... APS Division of Fluid Dynamics Meeting Abstracts, J16. 002, 2020 | | 2020 |