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.
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.
FIRST-PRINCIPLES INVESTIGATION OF RHODIUM HYDRIDES UNDER HIGH PRESSURE Статья Shao Z., Duan D., Wang L., Song H., Yu H., Cui T., Yao Y. Physical Review B. Том 104. 2021. 054110 с.
SOLID NITROGEN AND NITROGEN-RICH COMPOUNDS AS HIGH-ENERGY-DENSITY MATERIALS Статья Yao Y., Adeniyi A.O. Physica Status Solidi (B) Basic Research. 2021.
IRN<SUB>4</SUB>AND IRN<SUB>7</SUB>AS POTENTIAL HIGH-ENERGY-DENSITY MATERIALS Статья Du X., Wang J., Yang Q., Yang G., Yao Y. The Journal of Chemical Physics. Том 154. 2021. 054706 с.
SYNTHESIS OF SUPERCONDUCTING SBS AND SB S2 ANTIMONY CHALCOGENIDE COMPOUNDS AT HIGH PRESSURES Статья Zhang W., Tian F., Huang X., Xie H., Duan D., Cui T., Yao Y., Huang Y. Physical Review B. Том 103. 2021. 104102 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.
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.
HIGH-PRESSURE STRUCTURAL STUDY OF Α -MN: EXPERIMENTS AND CALCULATIONS Статья Magad-Weiss L.K., Stavrou E., Adeleke A.A., Yao Y., Greenberg E., Prakapenka V.B. Physical Review B. Том 103. 2021. 014101 с.
TWO GOOD METALS MAKE A SEMICONDUCTOR: A POTASSIUM-NICKEL COMPOUND UNDER PRESSURE Статья Adeleke A.A., Adeniyi A.O., Yao Y., Stavrou E., Wan B., Gou H. Physical Review B. Том 102. 2020. 134120 с.
PRESSURE-INDUCED STRUCTURAL TRANSFORMATIONS AND NEW POLYMORPHS IN BIVO<SUB>4</SUB> Статья Cheng X., Zhang H., Guan J., Song Y., Jiang L., Wang P., Adeniyi A.O., Yao Y., Su L. Physical Chemistry Chemical Physics. Том 22. 2020. С. 10238-10246
NITROGEN IN BLACK PHOSPHORUS STRUCTURE Статья Ji C., Yang L., Wan B., Gou H., Li B., Mao H.K., Adeleke A.A., Yao Y., Meng Y., Smith J.S., Shen G., Prakapenka V.B., Liu W., Mao W.L. Science Advances. American Association for the Advancement of Science. Том 6. 2020. EABA9206 с.
FORMATION OF STABLE COMPOUNDS OF POTASSIUM AND IRON UNDER PRESSURE Статья Adeleke A.A., Yao Y. Journal of Physical Chemistry A. American Chemical Society. Том 124. 2020. С. 4752-4763
HYDROGEN PENTAGRAPHENELIKE STRUCTURE STABILIZED BY HAFNIUM: A HIGH-TEMPERATURE CONVENTIONAL SUPERCONDUCTOR Статья Xie H., Duan D., Song H., Zhang Z., Jiang S., Cui T., Yao Y., Feng X., Redfern S.A.T., Pickard C.J., Kresin V.Z. Physical Review Letters. Том 125. 2020. 217001 с.
O-C<SUB>240</SUB>: A NEW SP<SUP>3</SUP>-DOMINATED ALLOTROPE OF CARBON Статья Adeleke A.A., Adeniyi A.O., Yao Y., Tang H., Gou H. Journal of Physics Condensed Matter. Том 32. 2020. 395401 с.