About Me

 I am a fifth-year at the University of Michigan in Ann Arbor and completed my undergraduate studies at the University of Chicago. My research involves simulating electronically nonadiabatic dynamics via the generalized quantum master equation combined with mixed quantum-classical, semiclassical, and exact methods. At Michigan, I have contributed to improvements of the Chemistry department, currently as a mentor through the Chemistry Mentorship Program and formerly as treasurer of the Chemistry Graduate Student Council, co-leader of the graduate student component of the Seminar Committee, and a representative of the graduate student body for the Department’s external review. I have also been involved in education research at Michigan through the Compute-to-Learn and Future Faculty Graduate Student Instructor program. Outside of my cubicle, I enjoy watching Chicago and Michigan sports, participating in intramurals, creating and viewing art, and playing piano.


Publications

  1. Liu, Y.; Gao, X.; Lai, Y.; Mulvihill, E.; Geva, E. Electronic Dynamics through Conical Intersections via Quasiclassical Mapping Hamiltonian Methods. J. Chem. Theory Comput. 2020, 16, 7, 4479–4488
  2. Mulvihill, E.; Gao, X.; Liu, Y.; Schubert, A.; Dunietz, B. D.; Geva, E. Combining the Mapping Hamiltonian Linearized Semiclassical Approach with the Generalized Quantum Master Equation to Simulate Electronically Nonadiabatic Molecular Dynamics. J. Chem. Phys. 2019, 151, 074103.
  3. Mulvihill, E.; Schubert, A.; Sun, X.; Dunietz, B. D.; Geva, E. A modified approach for simulating electronically nonadiabatic dynamics via the generalized quantum master equation. J. Chem. Phys. 2019, 150, 034101.
  4. Jafari, M.; Welden, A.R.; Williams, K.L.; Winograd, B.; Mulvihill, E.; Hendrickson, H.P.; Lenard, M.; Gottfried, A.; and Geva, E. Compute-to-Learn: Authentic Learning via Development of Interactive Computer Demonstrations within a Peer-Led Studio Environment. J. Chem. Educ. 2017, 94 (12), pp. 1896-1903.

Presentations

  1. 2020 Karle Symposium, Poster Session: "Generalized Quantum Master Equation: a reduced dynamics approach for electronically nonadiabatic dynamics." Mulvihill, E.; Gao, X.; Liu, Y.; Schubert, A.; Sun, X; Dunietz, B. D.; Geva, E. July 29th, 2020. Won Best Physical Chemistry Poster Award.
  2. 2020 Virtual Conference in Theoretical Chemistry, Lightning Talk and Poster Session: "Simulating Electronically Nonadiabatic Dynamics via the Generalized Quantum Master Equation."Mulvihill, E.; Gao, X.; Liu, Y.; Schubert, A.; Sun, X; Dunietz, B. D.; Geva, E. July 29th, 2020. Won Outstanding Lightning Talk Graduate Student Award.
  3. 2019 Penn Conference in Theoretical Chemistry, Poster Session: "Simulating Electronically Nonadiabatic Dynamics via a Modified Approach to the Generalized Quantum Master Equation." Mulvihill, E.; Gao, X.; Liu, Y.; Schubert, A.; Sun, X; Dunietz, B. D.; Geva, E. August 14th, 2019.
  4. 2019 Karle Symposium, Poster Session: "Simulating Electronically Nonadiabatic Dynamics via a Modified Generalized Quantum Master Equation." Mulvihill, E.; Gao, X.; Liu, Y.; Schubert, A.; Sun, X; Dunietz, B. D.; Geva, E. August 2nd, 2019.
  5. 2019 Midwest Theoretical Chemistry Conference, Oral Presentation: "Generalized Quantum Master Equation-based Approaches to Electronically Nonadiabatic Dynamics: Mapping Hamiltonian + LSC." Mulvihill, E.; Gao, X.; Liu, Y.; Schubert, A.; Sun, X.; Dunietz, B. D.; Geva, E. June 8th, 2019.
  6. Quantum Science and Technology Workshop at University of Michigan, Ann Arbor, MI, Poster Session: "A Modified Generalized Quantum Master Equation for Simulating Electronically Nonadiabatic Dynamics." Mulvihill, E.; Schubert, A.; Gao, X.; Liu, Y.; Sun, X.; Lai, Y.; Dunietz, B. D.; Geva, E. April 12th, 2019.
  7. Invited Research Presentation at Lafayette College, Easton, PA, Oral Presentation: "A Modified Generalized Quantum Master Equation for Simulating Electronically Nonadiabatic Dynamics." Mulvihill, E.; Lai, Y.; Schubert, A.; Sun, X.; Dunietz, B. D.; Geva, E. November 1st, 2018.
  8. 2018 Midwest Theoretical Chemistry Conference, Oral Presentation: "A Modified Generalized Quantum Master Equation for Simulating Electronically Nonadiabatic Dynamics." Mulvihill, E.; Lai, Y.; Schubert, A.; Sun, X.; Dunietz, B. D.; Geva, E. June 22nd, 2018.
  9. ACS National Meeting, New Orleans, LA, Physical Chemistry Poster Session: "A Modified Generalized Quantum Master Equation for Simulating Electronically Nonadiabatic Dynamics."Mulvihill, E.; Schubert, A.; Sun, X.; Lai, Y.; Dunietz, B. D.; Geva, E. March 21st, 2018. Won Outstanding Student Poster Award.
  10. ACS National Meeting, New Orleans, LA, Physical Chemistry Poster Session: "Compute-to-Learn: Authentic learning via development of interactive computer demonstrations within a peer-led studio environment." Jafari, M.; Welden, A.R.; Williams, K.L.; Winograd, B.; Mulvihill, E.; Hendrickson, H.P.; Lenard, M.; Gottfried, A.; Geva, E. March 18th, 2018.
  11. 2017 Midwest Theoretical Chemistry Conference, Poster Session: "Post-Marcus Electronic Transition Dynamics via the Generalized Quantum Master Equation." Mulvihill, E.; Schubert, A.; Sun, X.; Dunietz, B. D.; Geva, E. June 1st, 2017.
  12. 2017 MICDE Annual Symposium, Poster Session: "Post-Marcus Electronic Transition Dynamics via the Generalized Quantum Master Equation." Mulvihill, E.; Schubert, A.; Sun, X.; Dunietz, B. D.; Geva, E. April 18th, 2017.
  13. ACS National Meeting, San Francisco, CA, Physical Chemistry Poster Session: "Post-Marcus Electronic Transition Dynamics via the Generalized Quantum Master Equation." Mulvihill, E.; Schubert, A.; Sun, X.; Dunietz, B. D.; Geva, E. April 5th, 2017.

Contact

emulvi@umich.edu
Ellen Mulvihill
930 N. University Ave.
Ann Arbor, MI 48109