Xiaosong Li

140PUBLICATIONS
240CO-AUTHORS
Numerical solution of differential and integral equationsTheoretical quantum chemistryMain group metal chemistryElectronic and magnetic properties of condensed matter; superconductivitySurface properties of condensed matter
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Publications (140)

|Aug 06, 2026
Four-component relativistic density functional theory: grid requirements and small-component contributions.

|Jul 29, 2026
Ab initio two-spinor Ehrenfest dynamics with magnetic field.

|Jul 14, 2026
One-Pot, One-Step Mn-bis(imino)pyridine Complexes through Sonochemistry.

|Jul 01, 2026
Spin-orbit-resolved strong-field ionization from real-time relativistic dynamics.

|Jun 18, 2026
Time-Dependent Relativistic Two-Component Equation-of-Motion Coupled Cluster for Open-Shell Systems: TD-EA/IP-EOMCC.

|Apr 22, 2026
Instability of prevailing small molecule acceptors in organic solar cells toward water/nucleophiles.

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Frequent Collaborators

18 joint publications

Sharon Hammes-Schiffer

13 joint publications

Andrew Wildman

12 joint publications

Lin X Chen

12 joint publications

Andrew J Jenkins