Scientific Contributions

Peer-reviewed Articles

Published

  1. Martín A. Mosquera, Carlos H. Borca, Mark A. Ratner, and George C. Schatz. Connection Between Hybrid Functionals and Importance of the Local Density Approximation. The Journal of Physical Chemistry A, 2016, 120 (9), pp 1605–1612. DOI: 10.1021/acs.jpca.5b10864

  2. Carlos H. Borca and Carlos A. Arango. Molecular Dynamics of a Water-Absorbent Nano-Scale Material Based on Chitosan. The Journal of Physical Chemistry B, 2016, 120 (15), pp 3754–3765. DOI: 10.1021/acs.jpcb.5b11230

  3. Fulizi Xiong, Carlos H. Borca, Lyudmila V. Slipchenko, and Paul B. Shepson. Photochemical Degradation of Isoprene-derived 4,1-Nitrooxy Enal. Atmospheric Chemistry and Physics, 2016, 16, pp 5595–5610. DOI: 10.5194/acp-16-5595-2016

  4. Laura I. Mosquera-Giraldo, Carlos H. Borca, Xiangtao Meng, Kevin J. Edgar, Lyudmila V. Slipchenko, and Lynne S. Taylor. Mechanistic Design of Chemically Diverse Polymers with Applications in Oral Drug Delivery. Biomacromolecules, 2016, 17 (11), pp 3659–3671. DOI: 10.1021/acs.biomac.6b01156

  5. Carlos H. Borca, Lyudmila V. Slipchenko, and Adam Wasserman. Ground-State Charge Transfer: Lithium-Benzene and the Role of Hartree-Fock Exchange. The Journal of Physical Chemistry A, 2016, 120 (41) pp 8190–8198. DOI: 10.1021/acs.jpca.6b09014

  6. Na Li, Laura I. Mosquera-Giraldo, Carlos H. Borca, James D. Ormes, Michael Lowinger, John D. Higgins, Lyudmila V. Slipchenko, and Lynne S. Taylor. A Comparison of the Crystallization Inhibition Properties of Bile Salts. Crystal Growth & Design, 2016, 16 (12) pp 7286–7300. DOI: 10.1021/acs.cgd.6b01470

  7. Joel D. Rindelaub, Carlos H. Borca, Matt A. Hostetler, Mark A. Lipton, Lyudmila V. Slipchenko, and Paul B. Shepson. The Acid-Catalyzed Hydrolysis of an α-Pinene-Derived Organic Nitrate: Kinetics, Products, Reaction Mechanisms, and Atmospheric Impact. Atmospheric Chemistry and Physics, 2016, 16, pp 15425–15432. DOI: 10.5194/acp-16-15425-2016

  8. Sarah F. Tyler, Eileen C. Judkins, Dmitry Morozov, Carlos H. Borca, Lyudmila V. Slipchenko, and David R. McMillin, To Be or Not to Be Symmetric: That is the Question for Potentially Active Vibronic Modes. Journal of Chemical Education, 2017, 94 (9), pp 1232–1237. DOI: 10.1021/acs.jchemed.7b00289

  9. Naila A. Mugheirbi, Laura I. Mosquera-Giraldo, Carlos H. Borca, Lyudmila V. Slipchenko, and Lynne S. Taylor, Phase Behavior of Drug-Hydroxypropyl Methylcellulose Blends Produced from Various Solvent Systems: Mechanistic Understanding of the Role of Polymer using Experimental and Theoretical Methods. Molecular Pharmaceutics, 2018, 15 (8), pp 3236–3251. DOI: 10.1021/acs.molpharmaceut.8b00324

  10. Laura I. Mosquera-Giraldo, Carlos H. Borca, Andrew S. Parker, Yifan Dong, Kevin J. Edgar, Stephen P. Beaudoin, Lyudmila V. Slipchenko, and Lynne S. Taylor, Crystallization Inhibition Properties of Cellulose Esters and Ethers for a Group of Chemically Diverse Drugs - Experimental and Computational Insight. Biomacromolecules, 2018, 19 (12), pp 4593–4606. DOI: 10.1021/acs.biomac.8b01280

Under Review

In Preparation

Dissertations

Doctoral Thesis

Undergraduate Thesis