Qiang Zhu
TitleCited byYear
New developments in evolutionary structure prediction algorithm USPEX
AO Lyakhov, AR Oganov, HT Stokes, Q Zhu
Computer Physics Communications, 2012
Semimetallic Two-Dimensional Boron Allotrope with Massless Dirac Fermions
XF Zhou, X Dong, AR Oganov, Q Zhu, Y Tian, HT Wang
Phys. Rev. Lett. 112, 085502 (2014) 112, 085502, 2013
Unexpected stable stoichiometries of sodium chlorides
W Zhang, AR Oganov, AF Goncharov, Q Zhu, SE Boulfelfel, AO Lyakhov, ...
Science 342 (6165), 1502-1505, 2013
Report on the sixth blind test of organic crystal structure prediction methods
AM Reilly, RI Cooper, CS Adjiman, S Bhattacharya, AD Boese, ...
Acta Crystallographica Section B: Structural Science, Crystal Engineering …, 2016
Phagraphene: a low-energy graphene allotrope composed of 5–6–7 carbon rings with distorted dirac cones
Z Wang, XF Zhou, X Zhang, Q Zhu, H Dong, M Zhao, AR Oganov
Nano letters 15 (9), 6182-6186, 2015
Rational design of all organic polymer dielectrics
V Sharma, C Wang, RG Lorenzini, R Ma, Q Zhu, DW Sinkovits, G Pilania, ...
Nature communications 5, 4845, 2014
A stable compound of helium and sodium at high pressure
X Dong, AR Oganov, AF Goncharov, E Stavrou, S Lobanov, G Saleh, ...
Nature chemistry 9 (5), 440, 2017
Denser than diamond: Ab initio search for superdense carbon allotropes
Q Zhu, AR Oganov, MA Salvadó, P Pertierra, AO Lyakhov
Physical Review B 83 (19), 193410, 2011
Constrained evolutionary algorithm for structure prediction of molecular crystals: methodology and applications
Q Zhu, AR Oganov, CW Glass, HT Stokes
Acta Crystallographica Section B: Structural Science 68 (3), 215-226, 2012
Stability of xenon oxides at high pressures
Q Zhu, DY Jung, AR Oganov, CW Glass, C Gatti, AO Lyakhov
Nature Chemistry 5, 61-65, 2012
Novel Stable Compounds in the Mg-O System under High Pressure
Q Zhu, AR Oganov, AO Lyakhov
Phys. Chem. Chem. Phys., 2013
Systematic search for low-enthalpy sp^{3} carbon allotropes using evolutionary metadynamics
Q Zhu, Q Zeng, AR Oganov
Physical Review B 85 (20), 201407, 2012
Evolutionary method for predicting surface reconstructions with variable stoichiometry
Q Zhu, L Li, AR Oganov, PB Allen
Physical Review B 87 (19), 195317, 2013
Evolutionary metadynamics: a novel method to predict crystal structures
Q Zhu, AR Oganov, AO Lyakhov
CrystEngComm 14 (10), 3596-3601, 2012
The phase diagram and hardness of carbon nitrides
H Dong, AR Oganov, Q Zhu, GR Qian
Scientific reports 5, 9870, 2015
Pressure-induced stabilization and insulator-superconductor transition of BH
CH Hu, AR Oganov, Q Zhu, GR Qian, G Frapper, AO Lyakhov, HY Zhou
Physical review letters 110 (16), 165504, 2013
Variable-composition Structural Optimization and Experimental Verication of MnB3 and MnB4
H Niu, X Chen, W Ren, Q Zhu, AR Oganov, D Li, Y Li
Physical Chemistry Chemical Physics 16, 15866-15873, 2014
First-Principles Determination of the Structure of Magnesium Borohydride
XF Zhou, AR Oganov, GR Qian, Q Zhu
Physical Review Letters 109 (24), 245503, 2012
New Reconstructions of the (110) Surface of Rutile Predicted by an Evolutionary Method
Q Wang, AR Oganov, Q Zhu, XF Zhou
Physical review letters 113 (26), 266101, 2014
Evolutionary search for new high-k dielectric materials: methodology and applications to hafnia-based oxides
Q Zeng, AR Oganov, AO Lyakhov, C Xie, X Zhang, J Zhang, Q Zhu, B Wei, ...
Acta Crystallographica Section C: Structural Chemistry 70 (2), 76-84, 2014
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