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Chungen Liu - Publications

Affiliations: 
Nanjing University, Nanjing Shi, Jiangsu Sheng, China 
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26 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2023 Xu Y, Liu C, Ma H. Hierarchical Mapping for Efficient Simulation of Strong System-Environment Interactions. Journal of Chemical Theory and Computation. PMID 36626721 DOI: 10.1021/acs.jctc.2c00851  0.597
2021 Fu F, Liao K, Liu Z, Hong D, Yang H, Tian Y, Wei W, Liu C, Li S, Ma J, Li W. Controlled Fluorescence Enhancement of DNA-Binding Dye Through Chain Length Match between Oligoguanine and TOTO. The Journal of Physical Chemistry. B. PMID 33426891 DOI: 10.1021/acs.jpcb.0c09611  0.478
2019 Xie X, Liu Y, Yao Y, Schollwöck U, Liu C, Ma H. Time-dependent density matrix renormalization group quantum dynamics for realistic chemical systems. The Journal of Chemical Physics. 151: 224101. PMID 31837675 DOI: 10.1063/1.5125945  0.609
2019 Lai X, Du M, Meng F, Li G, Li W, Kyaw AKK, Wen Y, Liu C, Ma H, Zhang R, Fan D, Guo X, Wang Y, Ji H, Wang K, et al. High-Performance Inverted Planar Perovskite Solar Cells Enhanced by Thickness Tuning of New Dopant-Free Hole Transporting Layer. Small (Weinheim An Der Bergstrasse, Germany). e1904715. PMID 31642190 DOI: 10.1002/Smll.201904715  0.522
2019 Xie X, Santana-Bonilla A, Fang W, Liu C, Troisi A, Ma H. An exciton-phonon interaction model for singlet fission in prototypical molecular crystals. Journal of Chemical Theory and Computation. PMID 30970207 DOI: 10.1021/Acs.Jctc.9B00122  0.619
2019 Fu F, Liao K, Ma J, Cheng Z, Zheng D, Gao L, Liu C, Li S, Li W. How intermolecular interactions influence electronic absorption spectra: insights from the molecular packing of uracil in condensed phases. Physical Chemistry Chemical Physics : Pccp. PMID 30714590 DOI: 10.1039/c8cp06152a  0.498
2017 Luo Z, Ma Y, Liu C, Ma H. Efficient reconstruction of CASCI-type wave functions for a DMRG state using quantum information theory and genetic algorithm. Journal of Chemical Theory and Computation. PMID 28898080 DOI: 10.1021/acs.jctc.7b00439  0.554
2016 Zhang D, Liu C. The electronic structure of anti-ferromagnetic tetraradicals: an ab initio and semi-empirical study. Journal of Chemical Theory and Computation. PMID 26963572 DOI: 10.1021/acs.jctc.6b00103  0.322
2012 Zhang S, Qu Z, Tao P, Brooks B, Shao Y, Chen X, Liu C. A Quantum Chemical Study of the Ground and Excited State Electronic Structures of Carbazole Oligomers with and without Triarylborane Substitutes. The Journal of Physical Chemistry. C, Nanomaterials and Interfaces. 116: 12434-12442. PMID 22754601 DOI: 10.1021/Jp3027447  0.35
2011 Zhang D, Liu C. Electronic structures of low-lying Bu excited states in trans-oligoenes: Pariser-Parr-Pople and ab initio calculations. The Journal of Chemical Physics. 135: 134117. PMID 21992292 DOI: 10.1063/1.3643838  0.32
2011 Zhang D, Qu Z, Liu C, Jiang Y. Excitation energy calculation of conjugated hydrocarbons: a new Pariser-Parr-Pople model parameterization approaching CASPT2 accuracy. The Journal of Chemical Physics. 134: 024114. PMID 21241087 DOI: 10.1063/1.3526066  0.585
2011 Qu Z, Zhang S, Liu C, Malrieu JP. Communication: A dramatic transition from nonferromagnet to ferromagnet in finite fused-azulene chain. The Journal of Chemical Physics. 134: 021101. PMID 21241073 DOI: 10.1063/1.3533363  0.324
2009 Qu Z, Zhang D, Liu C, Jiang Y. Open-shell ground state of polyacenes: a valence bond study. The Journal of Physical Chemistry. A. 113: 7909-14. PMID 19527036 DOI: 10.1021/jp9015728  0.604
2009 MA H, LIU C, JIANG Y. BLOCK DENSITY MATRIX RENORMALIZATION GROUP WITH EFFECTIVE INTERACTIONS Journal of Theoretical and Computational Chemistry. 8: 837-848. DOI: 10.1142/S0219633609005064  0.596
2007 Ma H, Liu C, Zhang C, Jiang Y. Theoretical study of very high spin organic pi-conjugated polyradicals. The Journal of Physical Chemistry. A. 111: 9471-8. PMID 17696326 DOI: 10.1021/jp073300c  0.678
2007 Hu W, Ma H, Liu C, Jiang Y. Static polarizability and second hyperpolarizability of closed- and open-shell pi-conjugated polymers. The Journal of Chemical Physics. 126: 044903. PMID 17286505 DOI: 10.1063/1.2430702  0.653
2006 Ma H, Liu C, Jiang Y. Theoretical investigation of static characterization on nonlinear elementary excitations in trans-polyacetylene. The Journal of Physical Chemistry. B. 110: 26488-96. PMID 17181310 DOI: 10.1021/jp0602528  0.704
2005 Ma H, Liu C, Jiang Y. Theoretical study of the lowest pi-->pi* excitation energies for neutral and doped polyenes. The Journal of Chemical Physics. 123: 084303. PMID 16164287 DOI: 10.1063/1.2007589  0.689
2005 Ma H, Cai F, Liu C, Jiang Y. Spin distribution in neutral polyene radicals: Pariser-Parr-Pople model studied with the density matrix renormalization group method. The Journal of Chemical Physics. 122: 104909. PMID 15836360 DOI: 10.1063/1.1861875  0.691
2005 Cai F, Shao H, Liu C, Jiang Y. An alternative strategy for count and storage of Kekulé and longer range resonance valence bond structures. Journal of Chemical Information and Modeling. 45: 371-8. PMID 15807502 DOI: 10.1021/ci049770a  0.513
2004 Ma H, Liu C, Jiang Y. "Triplet-excited region" in polyene oligomers revisited: Pariser-Parr-Pople model studied with the density matrix renormalization group method. The Journal of Chemical Physics. 120: 9316-20. PMID 15267868 DOI: 10.1063/1.1710010  0.701
2003 Ma J, Li S, Liu C, Jiang Y. The Valence Bond Calculations on Conjugated Hydrocarbons of Medium to Infinite Sizes Journal of the Chinese Chemical Society. 50: 717-728. DOI: 10.1002/JCCS.200300103  0.609
2002 Gao Y, Liu C, Jiang Y. Electronic Structure of Thiophene Oligomer Dications:  An Alternative Interpretation from the Spin-Unrestricted DFT Study The Journal of Physical Chemistry A. 106: 5380-5384. DOI: 10.1021/JP025531J  0.541
2002 Gao Y, Liu C, Jiang Y. The Valence Bond Study for Benzenoid Hydrocarbons of Medium to Infinite Sizes The Journal of Physical Chemistry A. 106: 2592-2597. DOI: 10.1021/JP012057T  0.51
2001 Chen Z, Liu C, Chen Y, Jiang Y. Theoretical investigation on BaTiO3 with periodic density functional theory BLYP method Chemical Physics. 270: 253-261. DOI: 10.1016/S0301-0104(01)00400-1  0.507
1994 Liu C, Wang M, Shao Y, Jiang Y. Factorization of the Hückel Hamiltonian matrix for C540 Physics Letters A. 196: 120-124. DOI: 10.1016/0375-9601(94)91055-3  0.484
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