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""""Alternative Approach to Chemical Accuracy: A Neural Networks-Based First-Principles Method for Heat of Formation of Molecules Made of H, C, N, O, F, S, and Cl"""", J. Sun, J. Wu, T. Song, L.H. Hu, K.L. Shan, G.H. Chen, J. Phys. Chem. A (2014). DOI:10.1021/jp502096y """"Interference and Molecular Transport—A Dynamical View: Time-Dependent Analysis of Disubstituted Benzenes"""", S.G. Chen, Y. Zhang, S. K. Koo, H. Tian, C. Y. Yam, G.H. Chen, M. A. Ratner, J. Phys. Chem. Lett., 5 (15), 2748–2752 (2014). DOI:10.1021/jz5007143 """"Quantum-Mechanical Prediction of Nanoscale Photovoltaics"""", Y. Zhang, L.Y. Meng, C. Y. Yam, G.H. Chen, J. Phys. Chem. Lett., 5, 1272−1277 (2014). DOI:10.1021/jz5003154 """"Frequency-domain multiscale quantum mechanics/electromagnetics simulation method"""", L.Y. Meng, Z.Y. Yin, C. Y. Yam, S. K. Koo, Q. Chen, N. Wong, G.H. Chen, J. Chem. Phys. 139, 244111 (2013). DOI:10.1063/1.4853635 """"Time-dependent density functional theory quantum transport simulation in non-orthogonal basis"""", Y. H. Kwok, H. Xie, C. Y. Yam, X. Zheng, G.H. Chen, J. Chem. Phys. 139, 224111 (2013). DOI:10.1063/1.4840655 """"Time-dependent quantum transport theory and its applications to graphene nanoribbons"""", H. Xie, Y. H. Kwok, Y. Zhang, F. Jiang, X. Zheng, Y.J. Yan, G.H. Chen, Phys. Status Solidi B, 250: 2481–2494, (2013). DOI:10.1002/pssb.201349247 """"Gauge-invariant and current-continuous microscopic ac quantum transport theory"""", J.Q. Zhang, Z.Y. Yin, X. Zheng, C. Y. Yam, G.H. Chen, Eur. Phys. J. B, 86: 423, (2013). DOI:10.1140/epjb/e2013-40325-7 """"Application of hierarchical equations of motion (HEOM) to time dependent quantum transport at zero and finite temperatures"""", H. Tian, G.H. Chen, Eur. Phys. J. B, 86: 411, (2013). DOI:10.1140/epjb/e2013-40333-7 """"Synthesis of Constrained Head-to-Tail Cyclic Tetrapeptides by an Imine-Induced Ring-Closing / Contraction Strategy"""", C. T. T. Wong, H. Y. Lam, T. Song, G.H. Chen, X.C. Li, Angew. Chem. Int. Ed., 52: 10212–10215, (2013). DOI:10.1002/anie.201304773 """"A multi-scale modeling of junctionless field-effect transistors"""", C. Y. Yam, J. Peng, Q. Chen, S. Markov, J. Z. Huang, N. Wong, W. C. Chew, G.H. Chen, Appl. Phys. Lett. 103, 062109 (2013). DOI:10.1063/1.4817911 """"Time-dependent density functional theory for quantum transport"""", Y. H. Kwok, Y. Zhang, G.H. Chen, Front. Phys. (2013). DOI:10.1007/s11467-013-0361-5 """"Model Order Reduction for Multiband Quantum Transport Simulations and its Application to p-Type Junctionless Transistors"""", J. Z. Huang, W. C. Chew, J. Peng, C. Y. Yam, L. J. Jiang, G.H. Chen, IEEE Trans. on Elec. Dev. Vol. 60, No. 7, 2111-2119 (2013). DOI:10.1109/TED.2013.2260546 """"A Numerically Efficient Formulation for Time-Domain Electromagnetic-Semiconductor Cosimulation for Fast-Transient Systems"""", Q. Chen, W. Schoenmaker, G.H. Chen, L.J. Jiang, N. Wong, IEEE Trans. on CAD of IC and Sys. Vol. 32, No. 5, 802-806 (2013). DOI:10.1109/TCAD.2012.2232709 """"Dissipative time-dependent quantum transport theory"""", Y. Zhang, C. Y. Yam, G.H. Chen, J. Chem. Phys. 138, 164121 (2013). DOI:10.1063/1.4802592 """"Theoretical insights into [PMo12O40](3-) grafted on single-walled carbon nanotubes"""", S.Z. Wen, W. Guan, Y.H. Kan, G.C. Yang, N.N. Ma, L.K. Yan, Z.M. Su, G.H. Chen, Phys. Chem. Chem. Phys., 15, 9177 (2013). DOI:10.1039/c3cp51380g """"First-principles time-dependent quantum transport theory"""", Y. Zhang, S.G. Chen, G.H. Chen, Phys. Rev. B 87, 085110 (2013). DOI:10.1103/PhysRevB.87.085110 """"An efficient solution of Liouville-von Neumann equation that is applicable to zero and finite temperatures"""", H. Tian, and G.H. Chen, J. Chem. Phys. 137, 204114 (2012). DOI:10.1063/1.4767460 """"Quantum transport through an array of quantum dots"""", S.G. Chen, H. Xie, Y. Zhang, X.D. Cui, and G. H. Chen, Nanoscale, 2013, 5, 169. DOI:10.1039/c2nr32343e """"Time-dependent quantum transport: An efficient method based on Liouville-von-Neumann equation for single-electron density matrix"""", H. Xie, F. Jiang, H. Tian, X. Zheng, Y. H. Kwok, S.G. Chen, C. Y. Yam, Y. J. Yan, and G. H. Chen, J. Chem. Phys. 137, 044113 (2012). DOI:10.1063/1.4737864 """"Quantum Transport Simulations Based on Time Dependent Density Functional Theory"""", Thomas Niehaus and Guanhua Chen, Chapter 2 of """"Quantum Simulations of Materials and Biological Systems"""", p.17-32, Ed. Jun Zeng, Rui-Qin Zhang, Herbert R. Treutlein, Springer, 2012