Peifeng Su
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Explore the profile of Peifeng Su including associated specialties, affiliations and a list of published articles.
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56
Citations
338
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Recent Articles
1.
Li Z, Su P, Wang A, Su W, Pu J, Chen F, et al.
J Hazard Mater
. 2025 Mar;
490:137861.
PMID: 40058203
Solar-driven photocatalytic dehalogenation and mineralization of halogenated organic pollutants (HOPs) remain a significant challenge. In this study, we develop a dual-site confined g-CN (CN)-based catalyst, incorporating cerium doping and nitrogen...
2.
Wu X, Zheng P, Chen T, Zhou C, Su P, Wu W
Molecules
. 2025 Feb;
30(3).
PMID: 39942594
The accurate description of excited states is crucial for the development of electronic structure theory. In addition to determining excitation energies, strong state interactions arise when electronic states with the...
3.
Chen S, Ying F, Wu W, Su P
J Phys Chem A
. 2024 Nov;
128(49):10680-10688.
PMID: 39591642
An energy decomposition analysis method based on the constrained unrestricted mean-field (CUHF) theory, called GKS-EDA(CU), is presented for intermolecular interactions involving radicals. This method is able to take into account...
4.
Chen Y, Su P, Wang D, Ke Z, Tan G
Nat Commun
. 2024 Oct;
15(1):8810.
PMID: 39394208
No abstract available.
5.
Zhang Y, Xiong X, Wu W, Su P
J Chem Phys
. 2024 Aug;
161(8).
PMID: 39171702
In the work, a real-space energy decomposition analysis method, called DM-EDA(RS), is introduced based on our recently developed DM-EDA method [Zhang et al., J. Chem. Phys. 160, 174101 (2024)]. The...
6.
Chen Y, Su P, Wang D, Ke Z, Tan G
Nat Commun
. 2024 May;
15(1):4579.
PMID: 38811584
Phosphanorcaradienes are an appealing class of phosphorus compounds that can serve as synthons of transient phosphinidenes. However, the synthesis of such species is a formidable task owing to their intrinsic...
7.
Zhang Y, Yan L, Wu W, Su P
J Chem Phys
. 2024 May;
160(17).
PMID: 38747987
In this work, an energy decomposition analysis (EDA) method with the strategy of density matrix, called DM-EDA, is proposed on the basis of single reference electronic structure calculations. Different from...
8.
Xiong X, Friedman R, Wu W, Su P
J Phys Chem A
. 2024 Apr;
128(18):3529-3538.
PMID: 38687960
In this work, a QM/MM-based EDA method, called GKS-EDA(QM/MM), is proposed. As an extension of GKS-EDA, this scheme divides the total interaction energy into electrostatic, exchange-repulsion, polarization, and correlation/dispersion terms....
9.
Liu R, Zhang Z, Yan L, Yang X, Zhu Y, Su P, et al.
J Phys Chem Lett
. 2023 Oct;
14(41):9351-9356.
PMID: 37820388
Roaming bypasses the conventional transition state and is a significant reaction pathway due to the unusual energy distributions of its products; however, its reaction pathway under external environmental interactions remains...
10.
Tang Z, Shao B, Wu W, Su P
Phys Chem Chem Phys
. 2023 Jun;
25(27):18139-18148.
PMID: 37386854
Intermolecular interactions with excited states play important roles in various photochemical and photophysical processes. In this work, an energy decomposition analysis (EDA) method of intermolecular interactions for systems in which...