NOVEL BORON CHANNEL-BASED STRUCTURE OF BORON CARBIDE AT HIGH PRESSURES Article Zhang X., Cheng T., Chen H., Zhao Y., Zhang M., Liu H., Yao Y. Journal of Physics Condensed Matter. Vol. 29. 2017. 455401 p.
MODULATED STRUCTURE CALCULATED FOR SUPERCONDUCTING HYDROGEN SULFIDE Article Majumdar A., Tse J.S., Yao Y. Angewandte Chemie - International Edition. Vol. 56. 2017. P. 11390-11393
STRUCTURES AND STABILITY OF NOVEL TRANSITION-METAL (M = CO, RH, CO AND IR) BORIDES Article Wang Y., Wu L., Zhang Y., Zhang J., Lin Y., Hu Q., Gou H., Mao H.K., Li Z., Gao F., Liu H., Yao Y. Physical Review B - Condensed Matter and Materials Physics. Vol. 92. 2015. 174106 p.
HYDROGEN SEGREGATION AND ITS ROLES IN STRUCTURAL STABILITY AND METALLIZATION: SILANE UNDER PRESSURE Article Cui W., Shi J., Wang H., Ma Y., Liu H., Yao Y., Iitaka T. Scientific Reports. Nature Publishing Group. Vol. 5. 2015. 13039 p.
AMBIENT-PRESSURE POLYMERIZATION OF CARBON ANIONS IN THE HIGH-PRESSURE PHASE MG<SUB>2</SUB>C Article Stefanoski S., Strobel T.A., Liu H., Yao Y. Inorganic Chemistry. Vol. 54. 2015. P. 10761-10765
CRYSTALLINE LIN<SUB>5</SUB> PREDICTED FROM FIRST-PRINCIPLES AS A POSSIBLE HIGH-ENERGY MATERIAL Article Peng F., Yao Y., Liu H., Ma Y. Journal of Physical Chemistry Letters. American Chemical Society. Vol. 6. 2015. P. 2363-2366
THEORETICAL PREDICTIONS OF NOVEL SUPERCONDUCTING PHASES OF BAGE<SUB>3</SUB> STABLE AT ATMOSPHERIC AND HIGH PRESSURES Article Zurek E., Yao Y. Inorganic Chemistry. Vol. 54. 2015. P. 2875-2884
EXOTIC STABLE CESIUM POLYNITRIDES AT HIGH PRESSURE Article Peng F., Han Y., Liu H., Yao Y. Scientific Reports. Nature Publishing Group. Vol. 5. 2015. 16902 p.
STABLE STRUCTURES OF HE AND H2 O AT HIGH PRESSURE Article Liu H., Yao Y., Klug D.D. Physical Review B - Condensed Matter and Materials Physics. Vol. 91. 2015. 014102 p.
HIDDEN THERMODYNAMIC GROUND STATE OF CALCIUM DIAZENIDE Article Wang H., Si Y., Wu Z., Yao Y., Vaitheeswaran G. Journal of Physical Chemistry C. Vol. 118. 2014. P. 650-656
DIHYDROGEN BONDING IN COMPRESSED AMMONIA BORANE AND ITS ROLES IN STRUCTURAL STABILITY Article Yao Y., Yong X., Tse J.S., Greschner M.J. Journal of Physical Chemistry C. Vol. 118. 2014. P. 29591-29598
METALLIZATION AND SUPERCONDUCTIVITY OF BEH<SUB>2</SUB> UNDER HIGH PRESSURE Article Wang Z., Zhu L., Wang H., Ma Y., Yao Y., Liu H., Iitaka T. The Journal of Chemical Physics. Vol. 140. 2014. 124707 p.
STRUCTURES OF INSULATING PHASES OF DENSE LITHIUM Article Yao Y., Klug D.D., Tse J.S. Physical Review Letters. Vol. 102. 2009. 115503 p.
EFFECT OF PRESSURE ON THE IRON ARSENIDE SUPERCONDUCTOR LI<SUB>X</SUB> FEAS (X=0.8,1.0,1.1) Article Zhang S.J., Wang X.C., Yang L.X., Li Z., Liu Q.Q., Jin C.Q., Sammynaiken R., Tse J.S., Desgreniers S., Yao Y., Liu H.Z. Physical Review B - Condensed Matter and Materials Physics. Vol. 80. 2009. 014506 p.
CRYSTAL AND ELECTRONIC STRUCTURE OF SUPERHARD BC5: FIRST-PRINCIPLES STRUCTURAL OPTIMIZATIONS Article Yao Y., Klug D.D., Tse J.S. Physical Review B - Condensed Matter and Materials Physics. Vol. 80. 2009. 094106 p.
CORE EFFECTS ON THE ENERGETICS OF SOLID LI AT HIGH PRESSURE Article Yao Y., Tse J.S., Song Z., Klug D.D. Physical Review B - Condensed Matter and Materials Physics. Vol. 79. 2009. 092103 p.
SUPERCONDUCTIVITY IN LITHIUM UNDER HIGH PRESSURE INVESTIGATED WITH DENSITY FUNCTIONAL AND ELIASHBERG THEORY Article Yao Y., Tse J.S., Tanaka K., Marsiglio F., Ma Y. Physical Review B - Condensed Matter and Materials Physics. Vol. 79. 2009. 054524 p.
STRUCTURE AND ELECTRONIC PROPERTIES OF BAH<SUB>2</SUB> AT HIGH PRESSURE Article Tse J.S., Song Z., Yao Y., Smith J.S., Desgreniers S., Klug D.D. Solid State Communications. Vol. 149. 2009. P. 1944-1946
ELECTRONIC STRUCTURE OF Ε-OXYGEN AT HIGH PRESSURE: GW CALCULATIONS Article Tse J.S., Yao Y., Klug D.D., Desgreniers S. Physical Review B - Condensed Matter and Materials Physics. Vol. 78. 2008. 132101 p.
STRUCTURE AND SPECTROSCOPIC PROPERTIES OF DENSE SOLID HYDROGEN AT 160 GPA Article Tse J.S., Yao Y., Klug D.D., Page Y.L., Rodgers J.R. Solid State Communications. Vol. 145. 2008. P. 5-10
PRESSURE-INDUCED STRUCTURAL TRANSFORMATION IN SOLID XENON STUDIED BY RAMAN SPECTROSCOPY Article Shimizu H., Kume T., Sasaki S., Wada N., Yao Y., Tse J.S. Physical Review B - Condensed Matter and Materials Physics. Vol. 77. 2008. 052101 p.
PRESSURE-INDUCED HYDROGEN-DOMINANT METALLIC STATE IN ALUMINUM HYDRIDE Article Goncharenko I., Eremets M.I., Trojan I.A., Hanfland M., Amboage M., Tse J.S., Yao Y. Physical Review Letters. Vol. 100. 2008. 045504 p.
SUPERCONDUCTIVITY IN HYDROGEN DOMINANT MATERIALS: SILANE Article Eremets M.I., Trojan I.A., Medvedev S.A., Tse J.S., Yao Y. Science. American Association for the Advancement of Science. Vol. 319. 2008. P. 1506-1509
BONDING IN THE Ε-PHASE OF HIGH PRESSURE OXYGEN Article Tse S., Yao Y., Klug D., Desgreniers S. Journal of Physics: Conference Series. Vol. 121. 2008. 012006 p.
METASTABLE HIGH-PRESSURE SINGLE-BONDED PHASES OF NITROGEN PREDICTED VIA GENETIC ALGORITHM Article Yao Y., Tse J.S., Tanaka K. Physical Review B - Condensed Matter and Materials Physics. Vol. 77. 2008. 052103 p.
SUPERCONDUCTIVITY IN HIGH-PRESSURE SIH<SUB>4</SUB> Article Yao Y., Tse J.S., Tanaka K., Ma Y. EPL. Institute of Physics and IOP Publishing Limited. Vol. 78. 2007. 37003 p.
ELECTRON-PHONON COUPLING IN THE HIGH-PRESSURE HCP PHASE OF XENON: A FIRST-PRINCIPLES STUDY Article Yao Y., Tse J.S. Physical Review B - Condensed Matter and Materials Physics. Vol. 75. 2007.
SUPERCONDUCTIVITY IN HIGH-PRESSURE SOLIDS Article Tse J.S., Yao Y., Ma Y. Journal of Physics Condensed Matter. Vol. 19. 2007. 425208 p.