Shubin Liu

3PUBLICATIONS
4CO-AUTHORS
Theoretical quantum chemistryStatistical mechanics in chemistryComputational chemistry
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Publications (3)

|Oct 17, 2019
Identity for Kullback-Leibler divergence in density functional reactivity theory.

Shubin Liu

|Jun 03, 2019
Using Pauli energy to appraise the quality of approximate semilocal non-interacting kinetic energy density functionals.

Siyuan Liu, Dongbo Zhao, Chunying Rong

|Oct 09, 2017
Bonding reactivity descriptor from conceptual density functional theory and its applications to elucidate bonding formation.

Pan-Pan Zhou, Shubin Liu, Paul W Ayers

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