Razvan Caracas - Publications

Affiliations: 
Carnegie Institution for Science, USA 

66 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2020 Solomatova N, Caracas R, Cohen R. Carbon Speciation and Solubility in Silicate Melts Geophysical Monograph. 179-194. DOI: 10.1002/9781119508229.Ch16  0.382
2019 Reynard B, Caracas R, Cardon H, Montagnac G, Merkel S. High-pressure yield strength of rocksalt structures using quartz Raman piezometry Comptes Rendus Geoscience. 351: 71-79. DOI: 10.1016/J.Crte.2018.02.001  0.385
2018 Treviño P, Garcia-Castro AC, López-Moreno S, Bautista-Hernández A, Bobocioiu E, Reynard B, Caracas R, Romero AH. Anharmonic contribution to the stabilization of Mg(OH) from first principles. Physical Chemistry Chemical Physics : Pccp. PMID 29922777 DOI: 10.1039/C8Cp02490A  0.331
2018 Hernandez JA, Caracas R. Proton dynamics and the phase diagram of dense water ice. The Journal of Chemical Physics. 148: 214501. PMID 29884066 DOI: 10.1063/1.5028389  0.329
2017 Panero WR, Caracas R. Stability of phase H in the MgSiO 4 H 2 -AlOOH-SiO 2 system Earth and Planetary Science Letters. 463: 171-177. DOI: 10.1016/J.Epsl.2017.01.033  0.409
2016 Hernandez JA, Caracas R. Superionic-Superionic Phase Transitions in Body-Centered Cubic H_{2}O Ice. Physical Review Letters. 117: 135503. PMID 27715129 DOI: 10.1103/Physrevlett.117.135503  0.374
2016 Shahar A, Schauble EA, Caracas R, Gleason AE, Reagan MM, Xiao Y, Shu J, Mao W. Pressure-dependent isotopic composition of iron alloys. Science (New York, N.Y.). 352: 580-2. PMID 27126042 DOI: 10.1126/Science.Aad9945  0.366
2016 McCammon C, Caracas R, Glazyrin K, Potapkin V, Kantor A, Sinmyo R, Prescher C, Kupenko I, Chumakov AI, Dubrovinsky L. Sound velocities of bridgmanite from density of states determined by nuclear inelastic scattering and first-principles calculations Progress in Earth and Planetary Science. 3: 10. DOI: 10.1186/S40645-016-0089-2  0.357
2015 Caracas R, Hemley RJ. Ferroelectricity in high-density H2O ice. The Journal of Chemical Physics. 142: 134501. PMID 25854247 DOI: 10.1063/1.4916564  0.361
2015 Reynard B, Bezacier L, Caracas R. Serpentines, talc, chlorites, and their high-pressure phase transitions: a Raman spectroscopic study Physics and Chemistry of Minerals. 42: 641-649. DOI: 10.1007/s00269-015-0750-0  0.323
2015 Caracas R. The influence of hydrogen on the seismic properties of solid iron Geophysical Research Letters. 42: 3780-3785. DOI: 10.1002/2015Gl063478  0.338
2014 Caracas R, Ozawa H, Hirose K, Ishii H, Hiraoka N, Ohishi Y, Hirao N. Identifying the spin transition in Fe2+-rich MgSiO3 perovskite from X-ray diffraction and vibrational spectroscopy American Mineralogist. 99: 1270-1276. DOI: 10.2138/Am.2014.4783  0.37
2014 Pamato MG, Kurnosov A, Ballaran TB, Trots DM, Caracas R, Frost DJ. Chemistry and mineralogy of earth's mantle. Hexagonal Na0.41[Na0.125Mg0.79Al0.085]2[Al0.79Si0.21]6O12(NAL phase): Crystal structure refinement and elasticity American Mineralogist. 99: 1562-1569. DOI: 10.2138/Am.2014.4755  0.41
2014 Bobocioiu E, Caracas R. Stability and spectroscopy of Mg sulfate minerals: Role of hydration on sulfur isotope partitioning American Mineralogist. 99: 1216-1220. DOI: 10.2138/Am.2014.4632  0.351
2014 Černok A, Ballaran TB, Caracas R, Miyajima N, Bykova E, Prakapenka V, Liermann HP, Dubrovinsky AL. Pressure-induced phase transitions in coesite American Mineralogist. 99: 755-763. DOI: 10.2138/Am.2014.4585  0.455
2014 Journaux B, Caracas R, Carrez P, Gouriet K, Cordier P, Daniel I. Elasticity and dislocations in ice X under pressure Physics of the Earth and Planetary Interiors. 236: 10-15. DOI: 10.1016/J.Pepi.2014.08.002  0.388
2014 Fischer RA, Campbell AJ, Caracas R, Reaman DM, Heinz DL, Dera P, Prakapenka VB. Equations of state in the Fe-FeSi system at high pressures and temperatures Journal of Geophysical Research: Solid Earth. 119: 2810-2827. DOI: 10.1002/2013Jb010898  0.399
2013 Avril C, Malavergne V, Caracas R, Zanda B, Reynard B, Charon E, Bobocioiu E, Brunet F, Borensztajn S, Pont S, Tarrida M, Guyot F. Raman spectroscopic properties and Raman identification of CaS-MgS-MnS-FeS-Cr2FeS4 sulfides in meteorites and reduced sulfur-rich systems Meteoritics & Planetary Science. 48: 1415-1426. DOI: 10.1111/Maps.12145  0.329
2013 Caracas R, Cohen RE. Effect of Chemistry on the Physical Properties of Perovskite and Post-Perovskite Post-Perovskite: the Last Mantle Phase Transition. 115-128. DOI: 10.1029/174Gm010  0.583
2013 Parakhonskiy G, Vtech V, Dubrovinskaia N, Caracas R, Dubrovinsky L. Raman spectroscopy investigation of alpha boron at elevated pressures and temperatures Solid State Communications. 154: 34-39. DOI: 10.1016/J.Ssc.2012.10.026  0.369
2013 Gomi H, Ohta K, Hirose K, Labrosse S, Caracas R, Verstraete MJ, Hernlund JW. The high conductivity of iron and thermal evolution of the Earth's core Physics of the Earth and Planetary Interiors. 224: 88-103. DOI: 10.1016/J.Pepi.2013.07.010  0.32
2013 Montagnac G, Caracas R, Bobocioiu E, Vittoz F, Reynard B. Anharmonicity of graphite from UV Raman spectroscopy to 2700K Carbon. 54: 68-75. DOI: 10.1016/J.Carbon.2012.11.004  0.311
2013 Zhang D, Jackson JM, Chen B, Sturhahn W, Zhao J, Yan J, Caracas R. Elasticity and lattice dynamics of enstatite at high pressure Journal of Geophysical Research: Solid Earth. 118: 4071-4082. DOI: 10.1002/Jgrb.50303  0.448
2012 Farfan G, Wang S, Ma H, Caracas R, Mao WL. Bonding and structural changes in siderite at high pressure American Mineralogist. 97: 1421-1426. DOI: 10.2138/Am.2012.4001  0.406
2012 Fischer RA, Campbell AJ, Caracas R, Reaman DM, Dera P, Prakapenka VB. Equation of state and phase diagram of Fe-16Si alloy as a candidate component of Earth's core Earth and Planetary Science Letters. 357: 268-276. DOI: 10.1016/J.Epsl.2012.09.022  0.4
2012 Ballaran TB, Kurnosov A, Glazyrin K, Frost DJ, Merlini M, Hanfland M, Caracas R. Effect of chemistry on the compressibility of silicate perovskite in the lower mantle Earth and Planetary Science Letters. 333: 181-190. DOI: 10.1016/J.Epsl.2012.03.029  0.393
2011 Caracas R, Bobocioiu E. The WURM project—a freely available web-based repository of computed physical data for minerals American Mineralogist. 96: 437-443. DOI: 10.2138/Am.2011.3532  0.335
2010 McKeown DA, Bell MI, Caracas R. Theoretical determination of the Raman spectra of single-crystal forsterite (Mg2SiO4) American Mineralogist. 95: 980-986. DOI: 10.2138/Am.2010.3423  0.332
2010 Dubrovinskaia N, Zarechnaya EY, Caracas R, Merlini M, Hanfland M, Filinchuk Y, Chernyshov D, Dmitriev V, Dubrovinsky L. Pressure-induced isostructural phase transformation in γ-B28 Acta Crystallographica Section A. 66. DOI: 10.1107/S0108767310096091  0.352
2010 Zarechnaya E, Dubrovinskaia N, Caracas R, Merlini M, Hanfland M, Filinchuk Y, Chernyshov D, Dmitriev V, Dubrovinsky L. Pressure-induced isostructural phase transformation in γ -B 28 Physical Review B. 82: 1-11. DOI: 10.1103/Physrevb.82.184111  0.398
2010 Caracas R. Elasticity of AlFeO3 and FeAlO3 perovskite and post-perovskite from first-principles calculations Geophysical Research Letters. 37. DOI: 10.1029/2010Gl044404  0.395
2010 Caracas R, Mainprice D, Thomas C. Is the spin transition in Fe2+‐bearing perovskite visible in seismology? Geophysical Research Letters. 37. DOI: 10.1029/2010Gl043320  0.327
2010 Caracas R. Spin and structural transitions in AlFeO3 and FeAlO3 perovskite and post-perovskite Physics of the Earth and Planetary Interiors. 182: 10-17. DOI: 10.1016/J.Pepi.2010.06.001  0.38
2010 Caracas R, Ballaran TB. Elasticity of (K,Na)AlSi3O8 hollandite from lattice dynamics calculations Physics of the Earth and Planetary Interiors. 181: 21-26. DOI: 10.1016/J.Pepi.2010.04.004  0.383
2009 Ballaran TB, Liu J, Dubrovinsky LS, Caracas R, Crichton W. High-pressure ferroelastic phase transition in aluminosilicate hollandite Physical Review B. 80: 214104. DOI: 10.1103/Physrevb.80.214104  0.406
2009 Caracas R, Banigan EJ. Elasticity and Raman and infrared spectra of MgAl2O4 spinel from density functional perturbation theory Physics of the Earth and Planetary Interiors. 174: 113-121. DOI: 10.1016/J.Pepi.2009.01.001  0.439
2009 Gonze X, Amadon B, Anglade PM, Beuken JM, Bottin F, Boulanger P, Bruneval F, Caliste D, Caracas R, Côté M, Deutsch T, Genovese L, Ghosez P, Giantomassi M, Goedecker S, et al. ABINIT: First-principles approach to material and nanosystem properties Computer Physics Communications. 180: 2582-2615. DOI: 10.1016/J.Cpc.2009.07.007  0.318
2009 Reynard B, Caracas R. D/H isotopic fractionation between brucite Mg(OH)2 and water from first-principles vibrational modeling Chemical Geology. 262: 159-168. DOI: 10.1016/J.Chemgeo.2009.01.007  0.343
2008 Caracas R. Dynamical instabilities of ice X. Physical Review Letters. 101: 085502. PMID 18764633 DOI: 10.1103/Physrevlett.101.085502  0.324
2008 Struzhkin VV, Goncharov AF, Caracas R, Mao HK, Hemley RJ. Synchrotron infrared spectroscopy of the pressure-induced insulator-metal transitions in glassy As2 S3 and As2 Se3 Physical Review B - Condensed Matter and Materials Physics. 77. DOI: 10.1103/Physrevb.77.165133  0.353
2008 Caracas R, Cohen R. Ferrous iron in post-perovskite from first-principles calculations Physics of the Earth and Planetary Interiors. 168: 147-152. DOI: 10.1016/J.Pepi.2008.06.002  0.551
2007 Caracas R. Raman spectra and lattice dynamics of cubic gauche nitrogen. The Journal of Chemical Physics. 127: 144510. PMID 17935412 DOI: 10.1063/1.2780844  0.407
2007 Caracas R, Cohen RE. Post-perovskite phase in selected sesquioxides from density-functional calculations Physical Review B. 76. DOI: 10.1103/Physrevb.76.184101  0.506
2007 Caracas R, Cohen RE. Prediction of polar ordered oxynitride perovskites Applied Physics Letters. 91: 092902. DOI: 10.1063/1.2776370  0.453
2007 Caracas R, Hemley RJ. New structures of dense nitrogen: Pathways to the polymeric phase Chemical Physics Letters. 442: 65-70. DOI: 10.1016/J.Cplett.2007.05.053  0.43
2006 Caracas R, Wentzcovitch RM. Theoretical determination of the structures of CaSiO3 perovskites. Acta Crystallographica. Section B, Structural Science. 62: 1025-30. PMID 17108656 DOI: 10.1107/S0108768106035762  0.387
2006 Caracas R, Gonze X. First-principles study of high-temperature phases ofK2SeO4 Physical Review B. 74. DOI: 10.1103/Physrevb.74.195111  0.39
2006 Caracas R, Cohen RE. Theoretical determination of the Raman spectra of MgSiO3perovskite and post-perovskite at high pressure Geophysical Research Letters. 33. DOI: 10.1029/2006Gl025736  0.598
2006 Li L, Weidner DJ, Brodholt J, Alfè D, Price GD, Caracas R, Wentzcovitch R. Phase stability of CaSiO3 perovskite at high pressure and temperature: Insights from ab initio molecular dynamics Physics of the Earth and Planetary Interiors. 155: 260-268. DOI: 10.1016/J.Pepi.2005.12.007  0.421
2006 Li L, Weidner DJ, Brodholt J, Alfè D, David Price G, Caracas R, Wentzcovitch R. Elasticity of CaSiO3 perovskite at high pressure and high temperature Physics of the Earth and Planetary Interiors. 155: 249-259. DOI: 10.1016/J.Pepi.2005.12.006  0.367
2005 Mao WL, Meng Y, Shen G, Prakapenka VB, Campbell AJ, Heinz DL, Shu J, Caracas R, Cohen RE, Fei Y, Hemley RJ, Mao HK. Iron-rich silicates in the Earth's D'' layer. Proceedings of the National Academy of Sciences of the United States of America. 102: 9751-3. PMID 15994226 DOI: 10.1073/Pnas.0503737102  0.554
2005 Caracas R, Gonze X. First-principle study of materials involved in incommensurate transitions Zeitschrift FüR Kristallographie - Crystalline Materials. 220. DOI: 10.1524/Zkri.220.5.511.65064  0.318
2005 Gonze X, Rignanese G, Caracas R. First-principle studies of the lattice dynamics of crystals, and related properties Zeitschrift FüR Kristallographie - Crystalline Materials. 220. DOI: 10.1524/Zkri.220.5.458.65077  0.402
2005 Degtyareva O, Caracas R, Gregoryanz E, Cohen R, Mao H, Hemley RJ. Charge-density wave in the incommensurate phase of metallic sulfur at megabar pressure Acta Crystallographica Section a Foundations of Crystallography. 61: c467-c467. DOI: 10.1107/S0108767305080554  0.531
2005 Caracas R, Gonze X. First-principles determination of the dynamical properties ofPb2MgTeO6 Physical Review B. 71. DOI: 10.1103/Physrevb.71.054101  0.37
2005 Caracas R. Effect of chemistry on the stability and elasticity of the perovskite and post-perovskite phases in the MgSiO3-FeSiO3-Al2O3system and implications for the lowermost mantle Geophysical Research Letters. 32. DOI: 10.1029/2005Gl023164  0.44
2005 Caracas R. Prediction of a new phase transition in Al2O3at high pressures Geophysical Research Letters. 32. DOI: 10.1029/2004Gl022204  0.417
2005 Caracas R, Wentzcovitch R, Price GD, Brodholt J. CaSiO3 perovskite at lower mantle pressures Geophysical Research Letters. 32: 1-5. DOI: 10.1029/2004Gl022144  0.432
2004 Caracas R, Gonze X. Structural, electronic, and dynamical properties of calaveriteAuTe2under pressure Physical Review B. 69. DOI: 10.1103/Physrevb.69.144114  0.422
2004 Caracas R, Wentzcovitch RM. Equation of state and elasticity of FeSi Geophysical Research Letters. 31. DOI: 10.1029/2004Gl020601  0.427
2004 Tsuchiya T, Caracas R, Tsuchiya J. First principles determination of the phase boundaries of high‐pressure polymorphs of silica Geophysical Research Letters. 31. DOI: 10.1029/2004Gl019649  0.427
2004 Caracas R, Gonze X. High-pressure isosymmetrical phase transition in calaverite Physics and Chemistry of Minerals. 31: 553-558. DOI: 10.1007/S00269-004-0417-8  0.458
2002 Caracas R. A database of incommensurate phases Journal of Applied Crystallography. 35: 120-121. DOI: 10.1107/S0021889801017083  0.364
2002 Caracas R, Gonze X. First-principles study ofSn2P2Se6ferroelectrics Physical Review B. 66. DOI: 10.1103/Physrevb.66.104106  0.328
2002 Caracas R, Gonze X. First-principles study ofPb2MgTeO6: High-Tcubic phase and average low-Trhombohedral phase Physical Review B. 65. DOI: 10.1103/Physrevb.65.184103  0.399
2001 Caracas R, Gonze X. Ab initio determination of the valence electron distribution in the average structure of the incommensurately modulated calaverite AuTe2. Acta Crystallographica. Section B, Structural Science. 57: 633-7. PMID 11574718 DOI: 10.1107/S0108768101011387  0.312
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