| Phonon dispersion measured directly from molecular dynamics simulations LT Kong Computer Physics Communications 182 (10), 2201-2207, 2011 | 299 | 2011 |
| Implementation of Green's function molecular dynamics: An extension to LAMMPS LT Kong, G Bartels, C Campaná, C Denniston, MH Müser Computer Physics Communications 180 (6), 1004-1010, 2009 | 80 | 2009 |
| Predicting shear transformation events in metallic glasses B Xu, ML Falk, JF Li, LT Kong Physical review letters 120 (12), 125503, 2018 | 74 | 2018 |
| Atomistic modeling of solid-state amorphization in an immiscible Cu-Ta system HR Gong, LT Kong, WS Lai, BX Liu Physical Review B 66 (10), 104204, 2002 | 67 | 2002 |
| Transition state theory of the preexponential factors for self-diffusion on Cu, Ag, and Ni surfaces LT Kong, LJ Lewis Physical Review B 74 (7), 073412, 2006 | 56 | 2006 |
| Correlation of magnetic moment versus spacing distance of metastable fcc structured iron LT Kong, BX Liu Applied physics letters 84 (18), 3627-3629, 2004 | 50 | 2004 |
| A comparative study on local atomic configurations characterized by cluster-type-index method and Voronoi polyhedron method YD Wei, P Peng, ZZ Yan, LT Kong, ZA Tian, KJ Dong, RS Liu Computational Materials Science 123, 214-223, 2016 | 45 | 2016 |
| Correlation of lattice constant versus tungsten concentration of the Ni-based solid solution examined by molecular dynamics simulation LT Kong, JB Liu, WS Lal, BX Liu Journal of alloys and compounds 337 (1-2), 143-147, 2002 | 38 | 2002 |
| Surface diffusion coefficients: Substrate dynamics matters LT Kong, LJ Lewis Physical Review B 77 (16), 165422, 2008 | 37 | 2008 |
| Correlation between mechanical behavior and glass forming ability of Zr–Cu metallic glasses BF Lu, JF Li, LT Kong, YH Zhou Intermetallics 19 (7), 1032-1035, 2011 | 36 | 2011 |
| Calculation of ferromagnetic states in metastable bcc and hcp Ni by projector-augmented wave method X He, LT Kong, BX Liu Journal of applied physics 97 (10), 2005 | 36 | 2005 |
| Size effects in Cu50Zr50 metallic glass films revealed by molecular dynamics simulations GJ Yang, B Xu, LT Kong, JF Li, S Zhao Journal of Alloys and Compounds 688, 88-95, 2016 | 34 | 2016 |
| Distinct magnetic states of metastable fcc structured Fe and Fe–Cu alloys studied by ab initio calculations LT Kong, BX Liu Journal of alloys and compounds 414 (1-2), 36-41, 2006 | 33 | 2006 |
| Solid-solution strengthening effects in binary Ni-based alloys evaluated by high-throughput calculations MX Wang, H Zhu, GJ Yang, K Liu, JF Li, LT Kong Materials & Design 198, 109359, 2021 | 32 | 2021 |
| The crucial role of chemical detail for slip-boundary conditions: molecular dynamics simulations of linear oligomers between sliding aluminum surfaces LT Kong, C Denniston, MH Müser Modelling and Simulation in Materials Science and Engineering 18 (3), 034004, 2010 | 29 | 2010 |
| Magnetic properties of Co and Co-Ag alloys in equilibrium/nonequilibrium structures studied by ab initio calculations LT Kong, RF Zhang, ZC Li, BX Liu Physical Review B 68 (13), 134446, 2003 | 29 | 2003 |
| Glass-forming ability determined by an n-body potential in a highly immiscible Cu-W system through molecular dynamics simulations HR Gong, LT Kong, WS Lai, BX Liu Physical Review B 68 (14), 144201, 2003 | 29 | 2003 |
| In situ modification of BiVO 4 nanosheets on graphene for boosting photocatalytic water oxidation S Liu, J Pan, X Li, X Meng, H Yuan, Y Li, Y Zhao, D Wang, J Ma, S Zhu, ... Nanoscale 12 (27), 14853-14862, 2020 | 26 | 2020 |
| Solid-liquid interfacial free energy and its anisotropy in the Cu-Ni binary system investigated by molecular dynamics simulations C Qi, B Xu, LT Kong, JF Li Journal of alloys and compounds 708, 1073-1080, 2017 | 26 | 2017 |
| Comparative study of metastable phase formation in the immiscible Cu–W system by ab initio calculation and n-body potential RF Zhang, LT Kong, HR Gong, BX Liu Journal of Physics: Condensed Matter 16 (29), 5251, 2004 | 26 | 2004 |
