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CDAC Publications 2017

1526.  Tomasino, D. and C.-s. Yoo, Time-resolved x-ray diffraction of Ti in dynamic-DAC.  AIP Conference Proceedings 1793, 060002 (2017).

1527.  Tafti, F. F., M. S. Torikachvili, R. S. Stillwell, B. Baer, E. Stavrou, S. T. Weir, Y. K. Vohra, H. Y. Yang, E. F. McDonnell, S. K. Kushwaha, Q. D. Gibson, R. J. Cava, and J. R. Jeffries, Tuning the electronic and the crystalline structure of LaBi by pressure: From extreme magnetoresistance to superconductivity.  Physical Review B 95, 014507 (2017).

1528.  Miao, M., R. Hoffmann, I. I. Naumov, and R. J. Hemley, Quasimolecules in compressed lithium.  Agnewandte Chemie International Edition 56, 972-975 (2017).

1529.  Mauger, L., J. E. Herriman, O. Hellman, S. J. Tracy, M. S. Lucas, J. A. Muñoz, Y. Xiao, J. Li, and B. Fultz, Phonons and elasticity of cementite through the Curie temperature.  Physical Review B 95, 024308 (2017).

1530.  Huang, Q., J. M. Rodgers, R. J. Hemley, and T. Ichiye, Extreme biophysics: Enzymes under pressure.  Journal of Computational Chemistry 38, 1174-1182 (2017).

1531.  Childress, L. B. and S. D. Jacobsen, High-pressure high-temperature Raman spectroscopy of kerogen: relevance to subducted organic carbon.  American Mineralogist 102, 391-403 (2017).

1532.  Rittman, D. R., R. I. Palomares, and M. Lang, Structure and elastic properties of Ln-doped UO2 (Ln = La, Nd) at high pressure.  Journal of Nuclear Materials 121, 045902 (2017).

1533. (FIS)  Liu, G., L. Kong, J. Gong, W. Yang, H.-k. Mao, Q. Hu, Z. Liu, R. D. Schaller, D. Zhang, and T. Xu, Pressure-induced bandgap optimization in lead-based perovskites with prolonged carrier lifetime and ambient retainability.  Advanced Functional Materials 27, 1604208 (2017).

1534.  Cai, W., R. Zhang, Y. Yao, and S. Deemyad, Piezochromism and structural and electronic properties of benz[a]anthracene under pressure.  Physical Chemistry – Chemical Physics 19, 6216-6223 (2017).

1535.  Ham, K. J., Y. Vohra, Y. Kono, A. A. Wereszczak, and P. Patel, White-beam x-ray diffraction and radiography studies on high-boron containing borosilicate glass at high pressure.  High Pressure Research 37, 233-243 (2017).

1536.  Rodgers, J. M. and T. Ichiye, Multipole moments of water molecules and the aqueous solvation of monovalent ions.  Journal of Molecular Liquids 228, 54-62 (2017).

1537.  Zhang, H., H. Liu, K. Wei, O. O. Kurakevych, Y. Le Godec, Z. Liu, G. S. Nolas, and T. A. Strobel, BC8 silicon (Si-III) is a narrow-gap semiconductor.  Physical Review Letters 118, 146601 (2017).

1538.  Ji, C., A. F. Goncharov, V. Shukla, N. K. Jena, D. Popov, B. Li, J. Wang, Y. Meng, V. B. Prakapenka, J. S. Smith, R. Ahuja, W. Yang, and H. -k. Mao, Stability of Ar(H2)2 to 358 GPa.  Proceedings of the National Academy of Sciences USA 114, 3596-3600 (2017).

1539.  Liu, X., Y. Y. Chang, S. N. Tkachev, C. R. Bina, and S. D. Jacobsen, Elastic and mechanical softening in boron-doped diamond.  Scientific Reports 7, 42921 (2017).

1540.  Wang, J., A. A. Banishev, W. P. Bassett, and D. D. Dlott, Fluorescence depolarization measurements under shock compression.  AIP Conference Proceedings 1793, 060007 (2017).

1541.  Shamp, A. and E. Zurek, Superconductivity in hydrides doped with main group elements under pressure.  Novel Superconducting Materials 3, 14-22 (2017).

1542.  Wu, X. J.-F. Lin, P. Kaercher, Z. Mao, J. Liu, V. Prakapenka, and H.-R. Wenk, Seismic anisotropy of the D” Layer induced by (001) deformation of post-perovskite.  Nature Communications 8, 14669 (2017).

1543.  Shaw, W. L. and D. D. Dlott, Mechanochemistry for shock wave energy dissipation.  AIP Conference Proceedings 1793, 030026 (2017).

1544.  Ryu, Y. J., C.-s. Yoo, M. Kim, X. Yong, J. Tse, S. K. Lee, and E. J. Kim, Hydrogen-doped polymeric carbon monoxide at high pressure.  Journal of Physical Chemistry C 121, 10078-10086 (2017).

1545.  Bassett, W. P. and D. D. Dlott, 32-Channel pyrometer with high dynamic range for studies of shocked nanothermites.  AIP Conference Proceedings 1793, 060012 (2017).

1546.  Bhadram, V. S., L. Krishna, E. S. Toberer, R. Hrubiak, E. Greenberg, V. B. Prakapenka, and T. A. Strobel, Pressure-induced structural transition in chalcopyrite ZnSiP2.  Applied Physics Letters 110, 182106 (2017).

1547.  Daviau, K. and K. K. M. Lee, Zinc-blende to rocksalt transition in SiC in a laser-heated diamond-anvil cell.  Physical Review B 95, 134108 (2017).

1548.  Yim, W. L., H. Shi, Y. Liang, R. J. Hemley, and J. S. Tse, Band gaps and effective oscillator models for solid hydrogen and H2O ice at high pressure. In Correlations in Condensed Matter under Extreme Conditions, Eds. Angilella, G. G. N and A. La Magna, A.  Cham, Switzerland: Springer AG (2017).

1549.  Dlott, D. D., Shock compression dynamics under a microscope. AIP Conference Proceedings 1793, 020001 (2017).

1550.  Cai, W., M. Dunuwille, J. He, T. V. Taylor, J. K. Hinton, M. C. MacLean, J. J. Molaison, A. M. dos Santos, S. Sinogeikin, and S. Deemyad, Deuterium isotope effects in polymerization of benzene under pressure.  Journal of Physical Chemistry Letters 8, 1856-1864 (2017).

1551.  Elatresh, S. F., W. Cai, N. W. Ashcroft, R. Hoffman, S. Deemyad, and S. A. Bonev, Evidence from Fermi surface analysis for the low-temperature structure of lithium.  Proceedings of the National Academy of Sciences USA 114, 5389-5394 (2017).

1552.  Grzelak, A., J. Gawraczyński, T. Jaroń, M. Somayazulu, M. Derzsi, V. V. Struzhkin, and W. Grochala, Persistence of mixed and non-intermediate valence in the high-pressure structure of silver (I,III) oxide, AgO: A combined Raman, x-ray diffraction (XRD), and density functional theory (DFT) study.  Inorganic Chemistry 56, 5804-5812 (2017).

1553.  Shamp, A., E. Zurek, T. Ogitsu, D. E. Fratanduono, and S. Hamel, Properties of B4C in the shocked state for pressures up to 1.5 TPa.  Physical Review B 95, 184111 (2017).

1554.  Cusick, A. B., M. Lang, F. W. Zhang, F. Sun, K. Sun, W. Li, P. Kluth, C. Trautmann, and R. C. Ewing, Amorphization of Ta2O5 under swift heavy ion irradiation.  Nuclear Instruments and Methods in Physics Research B 407, 25-33 (2017).

1555.  Hu, M., J. He, Z. Zhao, T. A. Strobel, W. Hu, D. Yu, H. Sun, L. Liu, Z. Li, M. Ma, Y. Kono, J. Shu, H.-k. Mao, Y. Fei, G. Shen, Y. Wang, S. J. Juhl, J. Y. Huang, Z. Liu, B. Xu, Y. Tian, Compressed glassy carbon: An ultrastrong and elastic interpenetrating graphene network.  Science Advances 3, e1603213 (2017).

1556.  Liu, H., I. I. Naumov, R. Hoffmann, N. W. Ashcroft, and R. J. Hemley, Novel structure with the potential for high Tc superconductivity in lantanum and yttrium hydrides at high pressure.  Proceedings of the National Academy of Sciences USA 114, 1704505114 (2017).

1557.  Huang, Q., J. M. Rodgers, R. J. Hemley, and T. Ichiye, Flexibility of dihydrofolate reductase from a piezophile and a mesophile: A molecular dynamics study.  Journal of Computational Chemistry 38, 1174-1182 (2017).

1558.  Palomares, R. I., J. Shamblin, C. L. Tracy, J. Neuefeind, R. C. Ewing, C. Trautmann, and M. Lang, Defect accumulation in swift heavy ion-irradiated CeO2 and ThO2Journal of Materials Chemistry A 5, 12193-12201 (2017).

1559.  Ackland, G. J., M. Dunuwille, M. Martinez-Canales, I. Loa, R. Zhang, S. V. Sinogeikin, W. Cai, and S. Deemyad, Quantum and isotope effects in lithium metal.  Science 356, 1254-1259 (2017).

1560.  Zha, C.-s., H. Liu, J. S. Tse, and R. J. Hemley, Melting and high P-T transitions of hydrogen to 300 GPa.  Physical Review Letters 119, 075302 (2017).

1561.  Zhang, R., W. Cai, T. Bi, N. Zarifl, T. Terpstra, C. Zhang, Z. V. Verdeny, E. Zurek, and S. Deemyad, Effects of nonhydrostatic stress on structural and optoelectronic properties of methylammonium lead bromide perovskite. Physical Chemistry Letters 8, 3457-3465 (2017).

1562. Tracy, C. L., S. Park, D. R. Rittman, S. J. ZInkle, H. Bei, M. Lang, R. C. Ewing, and W. L. Mao, High pressure synthesis of a hexagonal close-packed phase of the high-entropy alloy CrMnFeCoNi.  Nature Communications 8, 15634 (2017).

1563.  Guo, H., L. Zhu, H. T. Huang, A. Biswas, D. W. Keefer, B. L. Chaloux, C. Prescher, L. Yang, D. Y. Kim, M. D. Ward, J. Lerach, S. Wang, A. R. Oganov, A. Epshteyn, J. V. Badding, and T. A. Strobel, From linear molecular chains to extended polycyclic networks: Polymerization of dicyanoacetylene.  Chemistry of Materials  29, 6706-6718 (2017).

1564.  Clarke, S. M., M. Amsler, J. P. S. Walsh, T. Yu, Y. Wang, Y. Meng, S. D. Jacobsen, C. Wolverton, and D. E. Freedman, Creating binary Cu-Bi compounds via high-pressure synthesis: A combined experimental and theoretical study.  Chemistry of Materials 29, 5276-5285 (2017).

1565.  Ahart, M., D. Aihaiti, R. J. Hemley, and S. Kojima, Pressure dependence of the Boson peak of glassy glycerol.  Journal of Physical Chemistry C 119, 6667-6672 (2017).

1566.  Rodgers, J. M., R. J. Hemley, and T. Ichiye, Quasiharmonic analysis of protein energy landscapes from pressure-temperature molecular dynamics simulations. Journal of Chemical Physics 147, 125103 (2017).

1567.  Perreault, C. S., N. Velisavljevic, and Y. K. Vohra, High-pressure structural parameters and equation of state of osmium to 207 GPa. Cogent Physics 4, 1376899 (2017).

1568.  Vadapoo, R., M. Ahart, M. Somayazulu, N. Holtgrewe, Y. Meng, Z. Konôpková, R. J. Hemley, and R. E. Cohen, Synthesis of polar ordered oxynitride perovskite. Physical Review B 95, 214120 (2017).

1569.  Zhang, J. S., Y. Hu, H. Shelton, J. Kung, and P. Dera, Single crystal x-ray diffraction study of Fe2SiO4 fayalite up to 31 GPa.  Physics and Chemistry of Minerals 44, 171-179 (2017).

1570.  Naumov, I. I. and R. J. Hemley, Metallic surface states in elemental electrides. Physical Review B 96, 035421 (2017).

1571.  Romanowicz, B. and H. R. Wenk, Anisotropy in the deep Earth.  Physics of the Earth and Planetary Interiors 269, 58-90 (2017).

1572.  Bi, T., D. J. Miller, A. Shamp, and E. Zurek, Superconducting phases of phosporous hydride under pressure: Stabilization via mobile molecular hydrogen.  Angewandte Chemie International Edition 129, 10326-10329 (2017).

1573.  Ransom, T. C., M. Ahart, R. J. Hemley, and C. M. Roland, Vitrification and density scaling of polyurea at pressures up to 6 GPa. Macromolecules 50, 8274-8278 (2017).