THEORY-DIRECTED DISCOVERY OF HIGH-TEMPERATURE SUPERCONDUCTIVITY IN CLATHRATE HYDRIDES AT HIGH PRESSURE Статья Zhong X., Tse J.S., Liu H., Hemley R.J. Innovation. Cell Press. Том 3. 2022. 100226 с.
PATH TO HIGH- T C SUPERCONDUCTIVITY VIA RB SUBSTITUTION OF GUEST METAL ATOMS IN THE SR B3 C3 CLATHRATE Статья Zhang P., Li X., Yang X., Liu H., Wang H., Yao Y. Physical Review B. Том 105. 2022. 094503 с.
QUANTUM AND CLASSICAL PROTON DIFFUSION IN SUPERCONDUCTING CLATHRATE HYDRIDES Статья Wang H., Yao Y., Peng F., Liu H., Hemley R.J. Physical Review Letters. Том 126. 2021. 117002 с.
NEW-PHASE RETENTION IN COLLOIDAL CORE/SHELL NANOCRYSTALS: VIA PRESSURE-MODULATED PHASE ENGINEERING Статья Wang Y., Liu H., Wu M., Wang K., Sui Y., Liu Z., Yang X., Zou B., Lu S., Nie Z., Tse J.S. Chemical Science. Royal Society of Chemistry. Том 12. 2021. С. 6580-6587
MACHINE LEARNING METADYNAMICS SIMULATION OF RECONSTRUCTIVE PHASE TRANSITION Статья Tong Q., Luo X., Gao P., Xie Y., Liu H., Li Q., Wang Y., Lv J., Ma Y., Adeleke A.A., Yao Y. Physical Review B. Том 103. 2021. 054107 с.
PREDICTION OF A STABLE HELIUM-HYDROGEN COMPOUND: FIRST-PRINCIPLES SIMULATIONS Статья Adeniyi A.O., Adeleke A.A., Yao Y., Li X., Liu H. Physical Review B. Том 104. 2021. 024101 с.
POTASSIUM-ACTIVATED ANIONIC COPPER AND COVALENT CU-CU BONDING IN COMPRESSED K-CU COMPOUNDS Статья Cao X., Wu L., Wan B., Liu H., Yao Y., Gou H. The Journal of Chemical Physics. Том 154. 2021. 134708 с.
AN AUTOMATED PREDICTOR FOR IDENTIFYING TRANSITION STATES IN SOLIDS Статья Yin K., Gao P., Shao X., Gao B., Liu H., Lv J., Tse J.S., Wang Y., Ma Y. Npj Computational Materials. Том 6. 2020. 16 с.
PRESSURE-INDUCED DECOMPOSITION OF BINARY LANTHANUM INTERMETALLIC COMPOUNDS Статья Yang X., Li H., Liu H., Wang H., Xie Y., Yao Y. Physical Review B. Том 101. 2020. 184113 с.
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
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
THEORETICAL INVESTIGATION OF THE VALENCE STATES IN AU VIA THE AU-F COMPOUNDS UNDER HIGH PRESSURE Статья Liu G., Liu H., Feng X., Redfern S.A.T., Wang L., Gao G., Yong X. Physical Chemistry Chemical Physics. Том 21. 2019. С. 17621-17627
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
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.
CRYSTAL STRUCTURES AND ELECTRONIC PROPERTIES OF XE-CL COMPOUNDS AT HIGH PRESSURE Статья Zarifi N., Zurek E., Liu H., Tse J.S. Журнал физической химии С. Том 122. 2018. С. 2941-2950
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
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.
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
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.
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
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
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.
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.
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.
EXOTIC STABLE CESIUM POLYNITRIDES AT HIGH PRESSURE Статья Peng F., Han Y., Liu H., Yao Y. Scientific Reports. Nature Publishing Group. Том 5. 2015. 16902 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.
POLYMERIZATION OF NITROGEN IN AMMONIUM AZIDE AT HIGH PRESSURES Статья Yu H., Duan D., Tian F., Li D., Huang X., Liu Y., Liu B., Cui T., Liu H. Журнал физической химии С. Том 119. 2015. С. 25268-25272
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.
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.
PREDICTED TWO-DIMENSIONAL ELECTRIDES: LITHIUM-CARBON MONOLAYER SHEET Статья Lu M., Zhang M., Liu H. Physics Letters, Section A: General, Atomic and Solid State Physics. Том 379. 2015. С. 2511-2514
CRYSTAL STRUCTURES AND CHEMICAL BONDING OF MAGNESIUM CARBIDE AT HIGH PRESSURE Статья Liu H., Li Y., Tse J.S., Gao G., Hao J. Журнал физической химии С. Том 119. 2015. С. 23168-23174
THE ELECTRICAL CONDUCTIVITY OF AL<SUB>2</SUB>O<SUB>3</SUB> UNDER SHOCK-COMPRESSION Статья Liu H., Tse J.S., Nellis W.J. Scientific Reports. Nature Publishing Group. Том 5. 2015. 12823 с.
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.
PREDICTION OF NOVEL CRYSTAL STRUCTURES AND SUPERCONDUCTIVITY OF COMPRESSED HBR Статья Lu S., Yang B., Wu M., Liu H., Tse J.S. RSC Advances. Том 5. 2015. С. 45812-45816
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. Журнал физической химии С. Том 119. 2015. С. 21649-21657
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.
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
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.
HARDNESS OF FEB<SUB>4</SUB>: DENSITY FUNCTIONAL THEORY INVESTIGATION Статья Zhang M., Du Y., Gao L., Lu M., Lu C., Liu H. The Journal of Chemical Physics. Том 140. 2014. 174505 с.
THE METALLIZATION AND SUPERCONDUCTIVITY OF DENSE HYDROGEN SULFIDE Статья Li Y., Hao J., Liu H., Ma Y. The Journal of Chemical Physics. Том 140. 2014. 174712 с.
METALLIZATION AND SUPERCONDUCTIVITY OF BEH<SUB>2</SUB> UNDER HIGH PRESSURE Статья Wang Z., Zhu L., Wang H., Ma Y., Yao Y., Liu H., Iitaka T. The Journal of Chemical Physics. Том 140. 2014. 124707 с.
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STABILITY OF ROCKSALT PHASE OF ZINC OXIDE UNDER STRONG COMPRESSION: SYNCHROTRON X-RAY DIFFRACTION EXPERIMENTS AND FIRST-PRINCIPLES CALCULATION STUDIES Статья Liu H., Mao H.-K., Tse J.S. Journal of Applied Physics. Том 100. 2006.