https://iochem-bd.bsc.es/browse/handle/100/501134 CO₂ Chemisorption in Choline–Imidazolate DES Fri, 31 Jul 2026 08:59:20 GMT 2026-07-31T08:59:20Z https://iochem-bd.bsc.es/browse/handle/100/501203 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 Tue, 21 Jul 2026 05:09:21 GMT https://iochem-bd.bsc.es/browse/handle/100/501203 2026-07-21T05:09:21Z https://iochem-bd.bsc.es/browse/handle/100/501202 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. Tue, 21 Jul 2026 05:09:19 GMT https://iochem-bd.bsc.es/browse/handle/100/501202 2026-07-21T05:09:19Z https://iochem-bd.bsc.es/browse/handle/100/501201 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 Tue, 21 Jul 2026 05:09:19 GMT https://iochem-bd.bsc.es/browse/handle/100/501201 2026-07-21T05:09:19Z https://iochem-bd.bsc.es/browse/handle/100/501200 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 Tue, 21 Jul 2026 05:09:19 GMT https://iochem-bd.bsc.es/browse/handle/100/501200 2026-07-21T05:09:19Z