Xinxin Liu

Dr. Xinxin Liu


Research Focus & Metrics

Academic Career Length

2Years (2025-Present)

(Calculated once Scilit publication data is synced: current year − year of first publication + 1)

Representative Publications

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24 October 2025 in Preprints.org
Verified
Preprint
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XLXinxin Liu
Xinxin Liu
DPDaoling Peng
Daoling Peng
FGFeng Long Gu
Feng Long Gu
A unified electromagnetic response theory has been formulated in terms of quasi-energy derivatives within the nonrelativistic single-determinant framework. The formalism is applicable to both optical and non-optical electromagnetic responses, without restriction to monochromatic fields. Electromagnetic properties are expressed through quasi-energy derivatives, providing a consistent and general description under arbitrary static or dynamic perturbations. Magnetic properties obtained from this framework are inherently gauge-invariant, since a gauge transformation of the electromagnetic potentials corresponds to a unitary phase transformation acting on both the Hamiltonian and molecular orbitals. The present theory thus offers a comprehensive foundation for evaluating (hyper)polarizabilities, (hyper)magnetizabilities, and other related response properties.

14 November 2025 in Chemistry
Verified
Journal Article
Open access
PDF file
XLXinxin Liu
Xinxin Liu
DPDaoling Peng
Daoling Peng
FGFeng Long Gu
Feng Long Gu
A unified electromagnetic response theory has been formulated in terms of quasi-energy derivatives within the nonrelativistic single-determinant framework. The formalism is applicable to any type of optical response, without restriction to monochromatic fields. Electromagnetic properties are expressed through quasi-energy derivatives, providing a consistent and general description under arbitrary static or dynamic perturbations. Magnetic properties obtained from this framework are inherently gauge-invariant, since a gauge transformation of the electromagnetic potentials corresponds to a unitary phase transformation acting on both the Hamiltonian and molecular orbitals. The present theory thus offers a comprehensive foundation for evaluating (hyper)polarizabilities, (hyper)magnetizabilities, and other related response properties.