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CDAC Publications 2018

1574.  Herriman, J. E., O. Hellman and B. Fultz, Phonon thermodynamics and elastic behavior of GaN at high temperatures and pressures. Physical Review B 98, 214105 (2018).

1575.  Shelton, H., T. Bi, E. Zurek, J. Smith and P. Dera,  The ideal crystal structure of cristobalite X-I: A Bridge in SiO2 Densification. Journal of Physical Chemistry C 122, 17437-17446 (2018)

1576.  Cureton, W. F., R. Palomares, J. Walters, C. L. Tracy, C.-H. Chen, R. C. Ewing, G. Bidinnozi, J. Lian, C. Trautmann and M. Lang, Grain Size Effects on Irradiated CeO2, ThO2 and UO2. Acta Materialia 160, 47-56 (2018).

1577.  Arveson, S. M., B. Kiefer, J. Deng, Z. Liu and K. K. M. Lee, Thermally-Induced Coloration of KBr at High Pressures, Physical Review B 97, 094103 (2018).

1578.  Walsh, J. P. S. and D. E. Freedman,  High-Pressure Synthesis: A New Frontier in the Search for Next-Generation Intermetallic Compounds. Accounts of Chemical Research 51, DOI:10.1021/acs.accounts.8b00143 (2018).

1579.  Tehrani, A. M., A. O. Oliynyk, M. Perry, Z. Rizvi, S. Couper, F. Lin, L. Miyagi, T. D. Sparks and J. Brgoch, Machine Learning Directed Search for Ultraincompressible, Superhard Materials. Journal of the American Chemical Society 140, 9844-9853 (2018).

1580.   Shelyug, A., R. Palomares, M. Lang and A. Navrotsky, Energetics of Defect Production in Fluorite-Structured CeO2 Induced by Highly Ionizing Radiation.  Physical Review Materials 2, 093607 (2018).

1581.  O’Neal, K. R., A. J. Clune, N. C. Harms, S.-W. Cheong, J. Yang, Z. Liu, T. Birol, and J. L. Musfeldt, High Pressure Spectroscopic Investigation of Multiferroic Ni3TeO6Physical Review B 98, 184101.

1582.  Liu, G., J. Gong, R. Schaller, Q. Hu, Z. Liu, S. Yan, W. Yang, C. C. Stoumpos, M. G. Kanatzidis, H.-k. Mao and T. Xu, Isothermal Pressure-Dervided Metastable States in 2D Hybrid Perovskites Showing Enduring Bandgap Narrowing.  Proceedings of the National Academy of Sciences USA 115, 8076-8081 (2018).

1583.  Mishra, A. K., T. Muramatsu, H. Liu, Z. M. Geballe, M. Somayazulu, M. Ahart, M. Baldini, Y. Meng, E. Zurek and R. J. Hemley, New Calcium Hydrides with Mixed Atomic and Molecular Hydrogen.  Journal of Physical Chemistry C 122, 19370-19378 (2018).

1584.  Klein, R. A., J. P. S. Walsh, S. M. Clarke, Y. Guo, W. Bi, G. Fabbris, Y. Meng, D. Haskel, E. A. Alp, R. P. VanDuyne, S. D. Jacobsen and D. E. Freedman, Impact of Pressure on Magnetic Order in Jarosite.  Journal of the American Chemical Society 140, 12001-12009 (2018).

1585.  Daviau, K. and K. K. M. Lee, High Pressure, High Temperature Behavior of Silicon Carbide: A Review.  Crystals 8, Article 217 (2018).

1586.  Park, S., C.L. Tracy, F.X. Zhang, R.I. Palomares, C. Park, C. Trautmann, M. Lang, W.L. Mao, and R.C. Ewing, Swift heavy ion irradiation response and annealing behavior of A2TiO5 (A=Nd, Gd, and Yb).  Journal of Solid State Chemistry 258, 108-116 (2018).

1587.  Yang, F. C., O. Hellman, M. S. Lucas, H. L. Smith, C. N. Saunders, Y. Xiao, P. Chow and B. Fultz, Temperature Dependence of Phonons in Pd3Fe Through the Curie Temperature.  Physical Review B 98, 024301 (2018).

1588.  Celliers, P. M.; M. Millot, S. Brygoo, R. S. McWilliams, D. E. Fratanduono, J. R. Rygg, A. F. Goncharov, P. Loubeyre, J. H. Eggert, J. L. Peterson, N. B. Meezan, S. Le Pape, G. W. Collins, R. Jeanloz and R. J. Hemley, Insulator-Metal Transition in Dense Fluid Helium.  Science 361, 677-682 (2018).

1589.  Xi, X., X. Bo, X. S. Xu, P. P. Kong, Z. Liu, X. G. Hong, C. Q. Lin, G. Cao, X. Wan and G. L. Carr, Honeycomb Lattice Na2IrO3 at High Pressures: A Robust Spin-Orbit Mott Insulator. Physical Review B 98, 125117 (2018).

1590.  Amsler, M., V. I. Hegde, S. D. Jacobsen and C. Wolverton, Exploring the High-Pressure Materials Genome.  Physical Review X 8, 041021 (2018).

1591.  Zarifi, N., T. Bi, H. Liu and E. Zurek, Crystal Structures and Properties of Iron Hydrides and High Pressure.  Journal of Physical Chemistry C 122, 24262-24269 (2018).

1592.  Gaffney, J. A., A. Shamp, E. Zurek, et al., A Review of Equation of State Models for Inertial Confinement Fusion Materials. High Energy Density Physics 28, 7-24 (2018).

1593.  Fuentes, A. F., S. M. Montemayor, M. Maczka, M. Lang, R. C. Ewing, and U. Amador, A Critical Review of Existing Criteria for the Prediction of Pyrochlore Formation and Stability.  Inorganic Chemistry 57, 12093−12105 (2018).

1594.  Shamblin, C. L. Tracy, R. I. Palomares, E. C. O’Quinn, R. C. Ewing, J. Neuefeind, M. Feygenson, J. Behrens, C. Trautmann and M. Lang, Similar Local Order in Disordered Fluorite and Aperiodic Pyrochlore Structure, Acta Materialia 144, 60-67 (2018).

1595.  Heuser, M., R. I. Palomares, J. D. Bauer, M. J. Lozano Rodriguez, J. Cooper, M. Lang, A. C. Scheinost, H. Schlenz, B. Winkler, D. Bosbach, S. Neumeier and G. Deissmann, Structural characterization of (Sm,Tb)PO4 solid solutions and pressure-induced phase transitions, Journal of the European Ceramic Society 38, 4070–4081 (2018).

1596.  Ahart, M., M. Somayazulu, D. Popov, Y. Xie, X. Long, Z.-G Ye, R. E Cohen and R. J. Hemley, Pressure-Induced Transitions in Ferroelectric Single Crystal PbZr0.54Ti0.46O3Ferroelectrics 535:1, 106-113 (2018).

1597.  Basu, A., M. Ahart, N. Holtgrewe, C. Lin and R. J. Hemley, Pressure-Induced Transformations of Multiferroic Relaxor PbFe0.5Nb0.5O3Journal of Applied Physics 123, 084102 (2018).

1598.  Geballe, Z. M., H. Liu, A. K. Mishra, M. Ahart, M. Somayazulu, Y. Meng, M. Baldini and R. J. Hemley, Synthesis and Stability of Lanthanum Superhydrides. Angewandte Chemie International Edition 57, 688-692 (2018).

1599.  Yamanaka, T., Y. Nakamoto, M. Ahart and H.-k. Mao, Pressure Dependence of Electron Density Distribution and d-p-pi Hybridization in Titanate Perovskite Ferroelectrics.  Physical Review B 97, 144109 (2018).

1600.  Huang, Q., J. M. Rodgers, R. J. Hemley and T. Ichiye, Quasiharmonic Analysis of the Energy Landscapes of Dihydrofolate Reductase from Piezophiles and Mesophiles.  Journal of Physical Chemistry B 122, 5527-5533 (2018).

1601.  Ransom, T. C., M. Ahart, R. J. Hemley and C. M. Roland, Acoustic properties and density of polyurea at pressure up to 13.5 GPa through Brillouin scattering spectroscopy. Journal of Applied Physics 123, 195102 (2018).

1602.  Yamanaka, T., M. Ahart, H.-k. Mao and H. Yan, New high-pressure tetragonal polymorphs of SrTiO3 — molecular orbital and Raman band change under pressure. Journal of Physics: Condensed Matter 30, 265401 (2018).

1603.  Smith, H. L., Y. Shen, D. S. Kim, F. C. Yang, C. P. Adams, C. W. Li, D. L. Abernathy, M. B. Stone and B. Fultz, Temperature dependence of phonons in GeGe2. Physical Review Materials 2, 103602 (2018).

1604.  Tamerius, A. D., S. M. Clarke, M. Gu, J. P. S. Walsh, M. Esters, Y. Meng, C. H. Hendon, J. M. Rondinelli, S. D. Jacobsen and D. E. Freedman, Discovery of Cu3Pb. Angewandte Chemie International Edition 57, 12809-12813 (2018).

1605.  Park, S., C. L. Tracy, F. Zhang, C. Park, C. Trautmann, S. N. Tkachev, M. Lang, W. L. Mao and R. C. Ewing, Radiation-induced disorder in compressed lanthanide zirconates.  Physical Chemistry – Chemical Physics 20, 6187 (2018).

1606.  Fisher, R. A., A. J. Campbell, B. A. Chidester, D. M. Reaman, E. C. Thompson, J. S. Pigott, V. B. Prakapenka and J. S. Smith, Equations of state and phase boundary for stishovite and CaCl2-type SiO2American Mineralogist 103, 793-802 (2018).

1607.  Chidester, B. A., O. S. Pardo, R. A. Fisher, E. C. Thompson, D. L. Heinz, C. Prescher, V. B. Prakapenka and A. J. Campbell, High-pressure phase behavior and equations of state of ThO2 polymorphs.  American Mineralogist 103, 749-756 (2018).