Browse by Author Dzubak, Allison L.

Showing results 1 to 2 of 2

1
Ab initio carbon capture in open-site metal-organic frameworks

Dzubak, Allison L.; Lin, Li-Chiang; Kim, Jihan; Swisher, Joseph A.; Poloni, Roberta; Maximoff, Sergey N.; Smit, Berend; et al, NATURE CHEMISTRY, v.4, no.10, pp.810 - 816, 2012-10

2
CO2 Adsorption in Fe-2(dobdc): A Classical Force Field Parameterized from Quantum Mechanical Calculations

Borycz, Joshua; Lin, Li-Chiang; Bloch, Eric D.; Kim, Jihan; Dzubak, Allison L.; Maurice, Remi; Semrouni, David; et al, JOURNAL OF PHYSICAL CHEMISTRY C, v.118, no.23, pp.12230 - 12240, 2014-06

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