FIRST-PRINCIPLES MOLECULAR DYNAMICS SIMULATIONS OF SINGLE NITROGEN BOND STRUCTURES IN A N <SUB>2</SUB> –H <SUB>2</SUB> SYSTEM UNDER PRESSURE Статья Zhong X., Liu H., Tse J.S. Solid State Communications. Том 290. 2019. С. 27-30
HARD BN CLATHRATE SUPERCONDUCTORS Статья Li X., Liu H., Yong X., Lu S., Wu M., Meng S., Tse J.S., Li Y. Journal of Physical Chemistry Letters. American Chemical Society. Том 10. 2019. С. 2554-2560
SYNTHESIS OF XENON AND IRON-NICKEL INTERMETALLIC COMPOUNDS AT EARTH'S CORE THERMODYNAMIC CONDITIONS Статья Stavrou E., Zaug J.M., Yao Y., Goncharov A.F., Lobanov S.S., Liu H., Greenberg E., Prakapenka V.B. Physical Review Letters. Том 120. 2018. 096001 с.
PREDICTION OF STABLE IRON NITRIDES AT AMBIENT AND HIGH PRESSURES WITH PROGRESSIVE FORMATION OF NEW POLYNITROGEN SPECIES Статья Wu L., Tian R., Wan B., Gong N., Chen P., Shen T., Gou H., Liu H., Yao Y., Gao F. Chemistry of Materials. American Chemical Society. Том 30. 2018. С. 8476-8485
CRYSTAL STRUCTURES AND ELECTRONIC PROPERTIES OF XE-CL COMPOUNDS AT HIGH PRESSURE Статья Zarifi N., Zurek E., Liu H., Tse J.S. Journal of Physical Chemistry C. Том 122. 2018. С. 2941-2950
ELECTRON-PHONON COUPLING MECHANISMS FOR HYDROGEN-RICH METALS AT HIGH PRESSURE Статья Tanaka K., Tse J.S., Liu H. Physical Review B. Том 96. 2017. 100502 с.
SINGLE-BONDED ALLOTROPE OF NITROGEN PREDICTED AT HIGH PRESSURE Статья Adeleke A.A., Greschner M.J., Majumdar A., Yao Y., Wan B., Gou H., Liu H., Li Z. Physical Review B. Том 96. 2017. 224104 с.
HOW FUNCTIONAL GROUPS CHANGE THE ELECTRONIC STRUCTURE OF GRAPHDIYNE: THEORY AND EXPERIMENT Статья Ketabi N., Tolhurst T.M., Leedahl B., Moewes A., Liu H., Li Y. Carbon. Elsevier Ltd. Том 123. 2017. С. 1-6
CRYSTAL STRUCTURES OF CAB<SUB>3</SUB>N<SUB>3</SUB> AT HIGH PRESSURES Статья Zhang M., Chen J., Tse J.S., Guo Y., Zhu L., Liu H., Feng X., Redfern S.A.T. Inorganic Chemistry. Том 56. 2017. С. 7449-7453
NOVEL BORON CHANNEL-BASED STRUCTURE OF BORON CARBIDE AT HIGH PRESSURES Статья Zhang X., Cheng T., Chen H., Zhao Y., Zhang M., Liu H., Yao Y. Journal of Physics Condensed Matter. Том 29. 2017. 455401 с.
HIGH-PRESSURE HYDROGEN SULFIDE FROM FIRST PRINCIPLES: A STRONGLY ANHARMONIC PHONON-MEDIATED SUPERCONDUCTOR Статья Errea I., Calandra M., Mauri F., Pickard C.J., Nelson J., Needs R.J., Li Y., Liu H., Zhang Y., Ma Y. Physical Review Letters. Том 114. 2015. 157004 с.
AMBIENT-PRESSURE POLYMERIZATION OF CARBON ANIONS IN THE HIGH-PRESSURE PHASE MG<SUB>2</SUB>C Статья Stefanoski S., Strobel T.A., Liu H., Yao Y. Inorganic Chemistry. Том 54. 2015. С. 10761-10765
A NEW HIGH-PRESSURE POLYMERIC NITROGEN PHASE IN POTASSIUM AZIDE Статья Zhang M., Yan H., Wei Q., Liu H. RSC Advances. Том 5. 2015. С. 11825-11830
PRESSURE-INDUCED ZIGZAG PHOSPHORUS CHAIN AND SUPERCONDUCTIVITY IN BORON MONOPHOSPHIDE Статья Zhang X., Zhang S., Ma M., Liu R., Qin J., Liu H., Luo W., Ahuja R. Scientific Reports. Nature Publishing Group. Том 5. 2015. 8761 с.
UNRAVELING STABLE VANADIUM TETRABORIDE AND TRIBORIDE BY FIRST-PRINCIPLES COMPUTATIONS Статья Wu L., Wan B., Zhao Y., Zhang Y., Wang Y., Zhang J., Gou H., Liu H. Journal of Physical Chemistry C. Том 119. 2015. С. 21649-21657
STABLE STRUCTURES OF HE AND H2 O AT HIGH PRESSURE Статья Liu H., Yao Y., Klug D.D. Physical Review B - Condensed Matter and Materials Physics. Том 91. 2015. 014102 с.
FIRST-PRINCIPLES STUDY ON THE STRUCTURAL AND ELECTRONIC PROPERTIES OF METALLIC HFH<SUB>2</SUB> UNDER PRESSURE Статья Liu Y., Huang X., Duan D., Tian F., Li D., Zhao Z., Sha X., Yu H., Zhang H., Liu B., Cui T., Liu H. Scientific Reports. Nature Publishing Group. Том 5. 2015. 11381 с.
HIGH-ENERGY DENSITY AND SUPERHARD NITROGEN-RICH B-N COMPOUNDS Статья Li Y., Hao J., Liu H., Lu S., Tse J.S. Physical Review Letters. Том 115. 2015. 105502 с.
CRYSTALLINE LIN<SUB>5</SUB> PREDICTED FROM FIRST-PRINCIPLES AS A POSSIBLE HIGH-ENERGY MATERIAL Статья Peng F., Yao Y., Liu H., Ma Y. Journal of Physical Chemistry Letters. American Chemical Society. Том 6. 2015. С. 2363-2366
PREDICTION OF THE XE-HE BINARY PHASE DIAGRAM AT HIGH PRESSURES Статья Wang Y., Zhang J., Yang G., Liu H. Chemical Physics Letters. Elsevier. Том 640. 2015. С. 115-118
STRUCTURES AND STABILITY OF NOVEL TRANSITION-METAL (M = CO, RH, CO AND IR) BORIDES Статья 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. Том 92. 2015. 174106 с.
CRYSTAL STRUCTURES AND CHEMICAL BONDING OF MAGNESIUM CARBIDE AT HIGH PRESSURE Статья Liu H., Li Y., Tse J.S., Gao G., Hao J. Journal of Physical Chemistry C. Том 119. 2015. С. 23168-23174
HYDROGEN SEGREGATION AND ITS ROLES IN STRUCTURAL STABILITY AND METALLIZATION: SILANE UNDER PRESSURE Статья Cui W., Shi J., Wang H., Ma Y., Liu H., Yao Y., Iitaka T. Scientific Reports. Nature Publishing Group. Том 5. 2015. 13039 с.
PRESSURE-STABILIZED SUPERCONDUCTIVE YTTRIUM HYDRIDES Статья Li Y., Hao J., Wang Y., Ma Y., Liu H., Tse J.S. Scientific Reports. Nature Publishing Group. Том 5. 2015. 9948 с.
MECHANISMS FOR PRESSURE-INDUCED CRYSTAL-CRYSTAL TRANSITION, AMORPHIZATION, AND DEVITRIFICATION OF SNI<SUB>4</SUB> Статья Liu H., Tse J.S., Hu M.Y., Bi W., Zhao J., Alp E.E., Pasternak M., Taylor R.D., Lashley J.C. The Journal of Chemical Physics. Том 143. 2015. 164508 с.