Browse Collection: CO₂ Chemisorption in Choline–Imidazolate DES CO₂ Chemisorption in Choline–Imidazolate DES https://iochem-bd.bsc.es/browse/handle/100/501134 2026-07-31T08:59:40Z 2026-07-31T08:59:40Z /MEA DES System MD NVT Production Getman, Rachel Vicchio, Stephen Rabbani, S M Gulam Ikponmwosa, Osasumwen https://iochem-bd.bsc.es/browse/handle/100/501203 2026-07-21T05:11:18Z 2026-07-21T05:09:21Z Title: /MEA DES System MD NVT Production Authors: Getman, Rachel; Vicchio, Stephen; Rabbani, S M Gulam; Ikponmwosa, Osasumwen Abstract: GROMACS constant-volume and constant-temperature production simulation initiated from the equilibrated MEA system 2026-07-21T05:09:21Z /MEA DES System MD NPT equilibration Getman, Rachel Vicchio, Stephen Rabbani, S M Gulam Ikponmwosa, Osasumwen https://iochem-bd.bsc.es/browse/handle/100/501202 2026-07-21T05:11:18Z 2026-07-21T05:09:19Z Title: /MEA DES System MD NPT equilibration Authors: Getman, Rachel; Vicchio, Stephen; Rabbani, S M Gulam; Ikponmwosa, Osasumwen Abstract: GROMACS constant-pressure and constant-temperature equilibration simulation of the MEA system. 2026-07-21T05:09:19Z /MEA DES System MD NVT equilibration Getman, Rachel Vicchio, Stephen Rabbani, S M Gulam Ikponmwosa, Osasumwen https://iochem-bd.bsc.es/browse/handle/100/501201 2026-07-21T05:11:18Z 2026-07-21T05:09:19Z Title: /MEA DES System MD NVT equilibration Authors: Getman, Rachel; Vicchio, Stephen; Rabbani, S M Gulam; Ikponmwosa, Osasumwen Abstract: GROMACS constant-volume and constant-temperature equilibration simulation of the energy-minimized MEA system 2026-07-21T05:09:19Z /MEA DES System MD Energy Minimization Getman, Rachel Vicchio, Stephen Rabbani, S M Gulam Ikponmwosa, Osasumwen https://iochem-bd.bsc.es/browse/handle/100/501200 2026-07-21T05:11:18Z 2026-07-21T05:09:19Z Title: /MEA DES System MD Energy Minimization Authors: Getman, Rachel; Vicchio, Stephen; Rabbani, S M Gulam; Ikponmwosa, Osasumwen Abstract: GROMACS energy-minimization calculation performed on the initial MEA System 2026-07-21T05:09:19Z