Dong H Zhang
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Explore the profile of Dong H Zhang including associated specialties, affiliations and a list of published articles.
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Articles
182
Citations
567
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Recent Articles
1.
Liu S, Zhang D
J Chem Phys
. 2025 Feb;
162(7).
PMID: 39968827
To precisely study the effect of CH stretch excitation, we calculate the first seven-dimensional state-to-state integral cross sections (ICSs) for the Cl + CHD3(vCH = 0,1) → HCl + CD3...
2.
Li X, Fan W, Shao X, Fang W, Zhang D, Zhou M, et al.
J Phys Chem Lett
. 2025 Jan;
16(5):1320-1326.
PMID: 39873450
The photochemistry of nitrous acid (HONO) plays a crucial role in atmospheric chemistry as it serves as a key source of hydroxyl radicals (OH) in the atmosphere; however, our comprehension...
3.
Hao Y, Lu X, Fu B, Zhang D
J Chem Theory Comput
. 2025 Jan;
21(3):1046-1053.
PMID: 39841118
Symmetric functions, such as Permutationally Invariant Polynomials (PIPs) and Fundamental Invariants (FIs), are effective and concise descriptors for incorporating permutation symmetry into neural network (NN) potential energy surface (PES) fitting....
4.
Liu L, Fu Y, Wu H, Lu X, Dong W, Wang X, et al.
J Phys Chem Lett
. 2025 Jan;
16(2):460-467.
PMID: 39743775
Criegee intermediates (CIs) are potentially significant oxidants and a major source of OH radicals in the troposphere. The -CHCHOO intermediate has been confirmed as a crucial component of CIs in...
5.
Liu T, Fu B, Zhang D
J Chem Phys
. 2024 Dec;
161(23).
PMID: 39692491
Rotational excitations of reactants are often considered to have little impact on chemical reactivity compared to the excitations of vibrational modes and translational motion. Here, we reveal a significant influence...
6.
Zhang D, Wang X, Zhou M, Gai F
J Phys Chem A
. 2024 Nov;
128(46):9837-9838.
PMID: 39568363
No abstract available.
7.
Xu X, Chen J, Liu S, Zhang D
J Phys Chem A
. 2024 Nov;
128(48):10395-10403.
PMID: 39565966
Using the time-dependent wave-packet approach, we calculate the first fully converged state-to-state differential cross-sections for the H + HOD( = 1-4) → H + OD reactions on a highly accurate...
8.
Zhou Y, Lu Y, Zhang Z, Zhang D
J Chem Phys
. 2024 May;
160(20).
PMID: 38785279
This study presents a parallel algorithm for high-dimensional quantum dynamics simulations in poly atomic reactions, integrating distributed- and shared-memory models. The distributions of the wave function and potential energy matrix...
9.
Liu T, Fu B, Zhang D
J Chem Phys
. 2024 May;
160(17).
PMID: 38747993
We present a comprehensive investigation into the dissociative chemisorption of HOD on a rigid Ni(100) surface using an approximate full-dimensional (9D) quantum dynamics approach, which was based on the time-dependent...
10.
Peng T, Bai Y, Qi J, Fu Y, Han Y, Fu B, et al.
J Phys Chem A
. 2024 Mar;
128(12):2330-2338.
PMID: 38480504
An accurate, global, full-dimensional potential energy surface (PES) of NaCl + NaCl has been constructed by the fundamental invariant-neural network (FI-NN) fitting based on roughly 13,000 ab initio energies at...