Equation of state for technetium from X-ray diffraction and first-principle calculations

Mast, Daniel S.; Kim, Eunja; Siska, Emily M.; Poineau, Frederic; Czerwinski, Kenneth R.; Lavina, Barbara; Forster, Paul M.

doi:10.1016/j.jpcs.2016.03.007

Title: Equation of state for technetium from X-ray diffraction and first-principle calculations

Journal Article · Mon Aug 01 00:00:00 EDT 2016 · Journal of Physics and Chemistry of Solids

DOI:https://doi.org/10.1016/j.jpcs.2016.03.007· OSTI ID:1249257

Mast, Daniel S.; Kim, Eunja; Siska, Emily M.; Poineau, Frederic; Czerwinski, Kenneth R.; Lavina, Barbara; Forster, Paul M.

Cite

Export

Save

Research Organization:: Argonne National Lab. (ANL), Argonne, IL (United States). Advanced Photon Source (APS)

Sponsoring Organization:: NSFDOE-NNSA

OSTI ID:: 1249257

Journal Information:: Journal of Physics and Chemistry of Solids, Vol. 95, Issue C; ISSN 0022-3697

Publisher:: Elsevier

Country of Publication:: United States

Language:: ENGLISH

References (31)

T _c and its pressure dependence for technetium-based h.c.p. solid solution alloys Shelton, R. N.; Smith, T. F.; Koch, T. F. Journal of Physics F: Metal Physics, Vol. 5, Issue 10 https://doi.org/10.1088/0305-4608/5/10/015	journal	October 1975
∂Tc/∂P for technetium and a comment on its sign in relation to the other transition metal superconductors Chu, C. W.; Gardner, W. E.; Smith, T. F. Physics Letters A, Vol. 26, Issue 12 https://doi.org/10.1016/0375-9601(68)90161-8	journal	May 1968
Effect of Compression on the Decay Rate of ${Tc}^{99 m}$ Metal Porter, R. A.; McMillan, W. G. Physical Review, Vol. 117, Issue 3 https://doi.org/10.1103/PhysRev.117.795	journal	February 1960
Effect of Pressure on the Decay Constant of ${}^{99 m}{Tc}$ Mazaki, Hiromasa; Nagatomo, Tsuneto; Shimizu, Sakae Physical Review C, Vol. 5, Issue 5 https://doi.org/10.1103/PhysRevC.5.1718	journal	May 1972
Thermodynamic properties of technetium Guillermet, Armando Fernández; Grimvall, Göran Journal of the Less Common Metals, Vol. 147, Issue 2 https://doi.org/10.1016/0022-5088(89)90194-X	journal	March 1989
Application of Electron Microscopy in the Observation of Technetium and Technetium Dioxide Nanostructures Silva, G. W. Chinthaka; Poineau, Frederic; Ma, Longzhou Inorganic Chemistry, Vol. 47, Issue 24 https://doi.org/10.1021/ic8014628	journal	November 2008
New anvil designs in diamond-cells Boehler, Reinhard; De Hantsetters, Koen High Pressure Research, Vol. 24, Issue 3 https://doi.org/10.1080/08957950412331323924	journal	September 2004
Effective hydrostatic limits of pressure media for high-pressure crystallographic studies Angel, Ross J.; Bujak, Maciej; Zhao, Jing Journal of Applied Crystallography, Vol. 40, Issue 1 https://doi.org/10.1107/S0021889806045523	journal	January 2007
Two-dimensional detector software: From real detector to idealised image or two-theta scan Hammersley, A. P.; Svensson, S. O.; Hanfland, M. High Pressure Research, Vol. 14, Issue 4-6, p. 235-248 https://doi.org/10.1080/08957959608201408	journal	January 1996
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set Kresse, G.; Furthmüller, J. Physical Review B, Vol. 54, Issue 16, p. 11169-11186 https://doi.org/10.1103/PhysRevB.54.11169	journal	October 1996
Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation Perdew, John P.; Chevary, J. A.; Vosko, S. H. Physical Review B, Vol. 46, Issue 11 https://doi.org/10.1103/PhysRevB.46.6671	journal	September 1992
Accurate and simple analytic representation of the electron-gas correlation energy Perdew, John P.; Wang, Yue Physical Review B, Vol. 45, Issue 23, p. 13244-13249 https://doi.org/10.1103/PhysRevB.45.13244	journal	June 1992
Structural and magnetic properties of ${Tc}_{n} @ C_{60}$ endohedral metalofullerenes: First-principles predictions Weck, Philippe F.; Kim, Eunja; Czerwinski, Kenneth R. Physical Review B, Vol. 81, Issue 12 https://doi.org/10.1103/PhysRevB.81.125448	journal	March 2010
Interplay between structure, stoichiometry and properties of technetium nitrides Weck, Philippe F.; Kim, Eunja; Czerwinski, Kenneth R. Dalton Transactions, Vol. 40, Issue 25 https://doi.org/10.1039/c1dt10334b	journal	January 2011
Projector augmented-wave method Blöchl, P. E. Physical Review B, Vol. 50, Issue 24, p. 17953-17979 https://doi.org/10.1103/PhysRevB.50.17953	journal	December 1994
From ultrasoft pseudopotentials to the projector augmented-wave method Kresse, G.; Joubert, D. Physical Review B, Vol. 59, Issue 3, p. 1758-1775 https://doi.org/10.1103/PhysRevB.59.1758	journal	January 1999
High-precision sampling for Brillouin-zone integration in metals Methfessel, M.; Paxton, A. T. Physical Review B, Vol. 40, Issue 6 https://doi.org/10.1103/PhysRevB.40.3616	journal	August 1989
Special points for Brillouin-zone integrations Monkhorst, Hendrik J.; Pack, James D. Physical Review B, Vol. 13, Issue 12, p. 5188-5192 https://doi.org/10.1103/PhysRevB.13.5188	journal	June 1976
Isothermal equation of state for gold with a He-pressure medium Takemura, K.; Dewaele, A. Physical Review B, Vol. 78, Issue 10 https://doi.org/10.1103/PhysRevB.78.104119	journal	September 2008
Compression curves of transition metals in the Mbar range: Experiments and projector augmented-wave calculations Dewaele, Agnès; Torrent, Marc; Loubeyre, Paul Physical Review B, Vol. 78, Issue 10 https://doi.org/10.1103/PhysRevB.78.104102	journal	September 2008
Hydrostatic limits of 11 pressure transmitting media Klotz, S.; Chervin, J-C.; Munsch, P. Journal of Physics D: Applied Physics, Vol. 42, Issue 7, Article No. 075413 https://doi.org/10.1088/0022-3727/42/7/075413	journal	March 2009
Equation of state of rhenium and application for ultra high pressure calibration Anzellini, Simone; Dewaele, Agnès; Occelli, Florent Journal of Applied Physics, Vol. 115, Issue 4 https://doi.org/10.1063/1.4863300	journal	January 2014
Elastic moduli and Debye temperature of polycrystalline technetium by ultrasonic velocity measurements Love, G. R.; Koch, C. C.; Whaley, H. L. Journal of the Less Common Metals, Vol. 20, Issue 1 https://doi.org/10.1016/0022-5088(70)90039-1	journal	January 1970
Relation between Ultrasonically Measured Properties and the Coefficients in the Solid Equation of State Overton, William C. The Journal of Chemical Physics, Vol. 37, Issue 1 https://doi.org/10.1063/1.1732931	journal	July 1962
Implementation of micro-ball nanodiamond anvils for high-pressure studies above 6 Mbar Dubrovinsky, Leonid; Dubrovinskaia, Natalia; Prakapenka, Vitali B. Nature Communications, Vol. 3, Issue 1 https://doi.org/10.1038/ncomms2160	journal	January 2012
Effect of pressure and temperature on the lattice parameters of rhenium Liu, Lin-Gun; Takahashi, Taro; Bassett, William A. Journal of Physics and Chemistry of Solids, Vol. 31, Issue 6 https://doi.org/10.1016/0022-3697(70)90138-1	journal	June 1970
High-pressure x-ray diffraction studies on rhenium up to 216 GPa (2.16 Mbar) Vohra, Yogesh K.; Duclos, Steven J.; Ruoff, Arthur L. Physical Review B, Vol. 36, Issue 18 https://doi.org/10.1103/PhysRevB.36.9790	journal	December 1987
Theoretical isothermal equation of state of rhenium Sikka, S. K.; Vijayakumar, V. Physical Review B, Vol. 38, Issue 15 https://doi.org/10.1103/PhysRevB.38.10926	journal	November 1988
Ultrasonic equation of state of rhenium Manghnani, Murli H.; Katahara, Keith; Fisher, Edward S. Physical Review B, Vol. 9, Issue 4 https://doi.org/10.1103/PhysRevB.9.1421	journal	February 1974
Elastic and Bonding Properties of Transition Metals Walzer, U. physica status solidi (b), Vol. 125, Issue 1 https://doi.org/10.1002/pssb.2221250104	journal	September 1984
Bulk properties of the stabilized uniform ‘metallic’ electron gas in transition metals Wojciechowski, Kazimierz F. Physica B: Condensed Matter, Vol. 229, Issue 1 https://doi.org/10.1016/S0921-4526(96)00502-9	journal	December 1996

Cited By (2)

Zero-Kelvin Compression Isotherms of the Elements 1 ≤ Z ≤ 92 to 100 GPa Young, David A.; Cynn, Hyunchae; Söderlind, Per Journal of Physical and Chemical Reference Data, Vol. 45, Issue 4 https://doi.org/10.1063/1.4963086	journal	December 2016
Reverse-martensitic hcp-to-fcc transformation in technetium under shock compression Kim, Eunja; Weck, Philippe F.; Mattsson, Thomas R. Journal of Applied Physics, Vol. 124, Issue 3 https://doi.org/10.1063/1.5040148	journal	July 2018

Similar Records

Equation of state for technetium from X-ray diffraction and first-principle calculations

Journal Article · Sun Mar 20 00:00:00 EDT 2016 · Journal of Physics and Chemistry of Solids · OSTI ID:1249257

Mast, Daniel S.; Kim, Eunja; Siska, Emily M.; +4 more

Thermal equation of state of solid naphthalene to 13 GPa and 773 K: In situ X-ray diffraction study and first principles calculations

Journal Article · Mon Apr 28 00:00:00 EDT 2014 · Journal of Chemical Physics · OSTI ID:1249257

Rashchenko, Sergey V.; Chanyshev, Artem D.; Litasov, Konstantin D.; +2 more

The high pressure structure and equation of state of 2,6-diamino-3,5-dinitropyrazine-1-oxide (LLM-105) up to 20 GPa: X-ray diffraction measurements and first principles molecular dynamics simulations

Journal Article · Wed Oct 14 00:00:00 EDT 2015 · Journal of Chemical Physics · OSTI ID:1249257

Stavrou, Elissaios; Zaug, Joseph M.; Kuo, I-Feng W.; +4 more

Title: Equation of state for technetium from X-ray diffraction and first-principle calculations

Citation Formats

References (31)

Cited By (2)

Similar Records

Related Subjects