| Development of new interatomic potentials appropriate for crystalline and liquid iron MI Mendelev, S Han, DJ Srolovitz, GJ Ackland, DY Sun, M Asta Philosophical magazine 83 (35), 3977-3994, 2003 | 1529 | 2003 |
| Crystal-melt interfacial free energies in hcp metals: A molecular dynamics study of Mg DY Sun, MI Mendelev, CA Becker, K Kudin, T Haxhimali, M Asta, JJ Hoyt, ... Physical Review B—Condensed Matter and Materials Physics 73 (2), 024116, 2006 | 477 | 2006 |
| Generalized simulated annealing algorithm and its application to the Thomson model Y Xiang, DY Sun, W Fan, XG Gong Physics Letters A 233 (3), 216-220, 1997 | 289 | 1997 |
| Crystal-melt interfacial free energies and mobilities in fcc and bcc Fe DY Sun, M Asta, JJ Hoyt Physical Review B 69 (17), 174103, 2004 | 210 | 2004 |
| Kinetic coefficient of Ni solid-liquid interfaces from molecular-dynamics simulations DY Sun, M Asta, JJ Hoyt Physical Review B 69 (2), 024108, 2004 | 173 | 2004 |
| Atomistic simulations of nonequilibrium crystal-growth kinetics from alloy melts Y Yang, H Humadi, D Buta, BB Laird, D Sun, JJ Hoyt, M Asta Physical review letters 107 (2), 025505, 2011 | 137 | 2011 |
| Pressure-induced hard-to-soft transition of a single carbon nanotube DY Sun, DJ Shu, M Ji, F Liu, M Wang, XG Gong Physical Review B—Condensed Matter and Materials Physics 70 (16), 165417, 2004 | 127 | 2004 |
| Crystal-melt interfacial free energies in metals: fcc versus bcc DY Sun, M Asta, JJ Hoyt, MI Mendelev, DJ Srolovitz Physical Review B 69 (2), 020102, 2004 | 125 | 2004 |
| Determination of the crystal-melt interface kinetic coefficient from molecular dynamics simulations J Monk, Y Yang, MI Mendelev, M Asta, JJ Hoyt, DY Sun Modelling and Simulation in Materials Science and Engineering 18 (1), 015004, 2009 | 120 | 2009 |
| Influence of defects and dopants on the photovoltaic performance of Bi 2 S 3: first-principles insights D Han, MH Du, CM Dai, D Sun, S Chen Journal of Materials Chemistry A 5 (13), 6200-6210, 2017 | 100 | 2017 |
| The cooling rate dependence of crystallization for liquid copper: A molecular dynamics study CS Liu, J Xia, ZG Zhu, DY Sun The Journal of Chemical Physics 114 (17), 7506-7512, 2001 | 94 | 2001 |
| Generalized Simulated Annealing Studies on Structures and Properties of Nin (n = 2−55) Clusters Y Xiang, DY Sun, XG Gong The Journal of Physical Chemistry A 104 (12), 2746-2751, 2000 | 83 | 2000 |
| Structural properties and glass transition in clusters DY Sun, XG Gong Physical Review B 57 (8), 4730, 1998 | 79 | 1998 |
| Local magnetic properties and electronic structures of 3d and 4d impurities in Cu clusters Q Sun, XG Gong, QQ Zheng, DY Sun, GH Wang Physical Review B 54 (15), 10896, 1996 | 78 | 1996 |
| Molecular dynamics calculations of the crystal-melt interfacial mobility for hexagonal close-packed Mg ZG Xia, DY Sun, M Asta, JJ Hoyt Physical Review B—Condensed Matter and Materials Physics 75 (1), 012103, 2007 | 72 | 2007 |
| Structure and phase transitions of single-wall carbon nanotube bundles under hydrostatic pressure XH Zhang, DY Sun, ZF Liu, XG Gong Physical Review B—Condensed Matter and Materials Physics 70 (3), 035422, 2004 | 66 | 2004 |
| The molecular dynamics study of vacancy formation during solidification of pure metals HY Zhang, F Liu, Y Yang, DY Sun Scientific Reports 7 (1), 10241, 2017 | 56 | 2017 |
| Soft and hard shells in metallic nanocrystals DY Sun, XG Gong, XQ Wang Physical Review B 63 (19), 193412, 2001 | 53 | 2001 |
| Size-dependent melting behavior of iron nanoparticles by replica exchange molecular dynamics Q Shu, Y Yang, Y Zhai, DY Sun, HJ Xiang, XG Gong Nanoscale 4 (20), 6307-6311, 2012 | 51 | 2012 |
| A new constant-pressure molecular dynamics method for finite systems DY Sun, XG Gong Journal of Physics: Condensed Matter 14 (26), L487, 2002 | 50 | 2002 |
xin-gao gongfudan universityכתובת אימייל מאומתת בדומיין fudan.edu.cn
