Conveners and Chairpersons Azzurra Zucchini, Catherine McCammon, Paola Comodi and Mainak Mookherjee

ORAL SESSIONS

Wednesday 14 September 2016 (11.15-12.30)

Room - Marina

14-1    11.15 – 11.30
(KEYNOTE) Marquardt H.*, Kurnosov A., Boffa Ballaran T., Marquardt K., Frost D., Liermann H.-P., Speziale S., Miyagi L., Merkel S., Immoor J., Buchen J. & Schulze K.: INSIGHTS INTO THE NATURE OF EARTH'S MANTLE FROM ELASTICITY AND RHEOLOGY MEASUREMENTS AT HIGH-PRESSURE/HIGH-TEMPERATURE

14-2    11.30 – 11.45
Buchen J.*, Marquardt H., Kurnosov A., Speziale S., Kawazoe T. & Boffa Ballaran T.: INTERNALLY CONSISTENT SINGLE-CRYSTAL ELASTICITY OF IRON-BEARING WADSLEYITE AT HIGH PRESSURES AND HIGH TEMPERATURES

14-3    11.45 – 12.00
Angel R.J.*, Alvaro M., Gonzalez-Platas J. & Nestola F.: NEW FEATURES IN EosFit: FITTING ELASTIC MODULI AND PHASE TRANSITIONS

14-4    12.00 – 12.15
Woodland A.B.*, Uenver-Thiele L. & Boffa Ballaran T.: HIGH P-T STABILITY OF Fe₅O₆ AND ITS COEXISTENCE WITH OTHER Fe-OXIDES

14-5    12.15 – 12.30
Merli M., Bonadiman C., Diella V., Sciascia L. & Pavese A.*: HP-HT (Mg,Fe)O SUB-SOLIDUS REACTION MODELLING: IMPLICATIONS FOR LOWER MANTLE GEOCHEMICAL HETEROGENEITIES

Wednesday 14 September 2016 (14.00-15.15)

Room - Marina

14-6    14.00 – 14.15
Reali R.*, Boioli F., Gouriet K., Carrez P. & Cordier P.: MODELING PLASTICITY OF MgO AT THE MESOSCALE USING 2.5D DISLOCATION DYNAMICS

14-7    14.15 – 14.30
Jahn S.* & Koch-Müller M.: PHASE BEHAVIOR AND VIBRATIONAL PROPERTIES OF CALCITE-DERIVED CaCO₃ POLYMORPHS UP TO 30 GPa: A COMBINED COMPUTATIONAL AND EXPERIMENTAL STUDY

14-8    14.30 – 14.45
Gentili S., Speziale S.*, Zucchini A., Comodi P., Reichmann H.J. & Wunder B.: THE EFFECT OF CATIONS ORDER/DISORDER ON THE ELASTIC PROPERTIES OF DOLOMITE

14-9    14.45 – 15.00
Belmonte D.*: CAN WE PREDICT MELTING BEHAVIOUR OF MINERALS AT DEEP MANTLE CONDITIONS ?

14-10    15.00 – 15.15
Gouriet K.^*1, Boioli F., Devincre B., Carrez P. & Cordier P.: MODELING THE CREEP PROPERTIES OF OLIVINE IN THE LITHOSPHERIC MANTLE FROM DISLOCATION DYNAMICS MODELS

Wednesday 14 September 2016 (15.45-17.00)

Room - Marina

14-11    15.45 – 16.00
(KEYNOTE) Blanchard M.*: CRYSTAL-CHEMICAL AND ISOTOPIC PROPERTIES OF MINERALS BY COMBINING COMPUTATIONAL AND SPECTROSCOPIC TECHNIQUES

14-12    16.00 – 16.15
Ohmann S.*, Ufer K., Dohrmann R. & Kaufhold S.: DATA RECONCILIATION BETWEEN XRD AND CHEMICAL COMPOSITION DATA FOR QUANTITATIVE ANALYSIS BY LINEAR PROGRAMMING

14-13    16.15 – 16.30
Kowalski P.M.*, Beridze G., Ji Y. & Li Y.: RELIABLE AND EFFICIENT AB INITIO SIMULATIONS OF COMPUTATIONALLY CHALLENGING MATERIALS

14-14    16.30 – 16.45
Kéri A.*, Dähn R., Krack M. & Churakov S.: COMBINED AB INITIO AND EXAFS SPECTROSCOPY STUDY ON THE CHARACTERISTICS OF IRON UPTAKE BY CLAY MINERALS

14-15    16.45 – 17.00
Evans R.J.* & Groat L.A.: CHARACTERIZING THE DISTORTIONS AND BOND TOPOLOGY OF TETRAHEDRAL AND OCTAHEDRAL GROUPS IN MINERAL CRYSTAL STRUCTURES

POSTER SESSION

Wednesday 14 September 2016

Poster Area - Foyer della Domus

14-16    Panel number 38

Caracas R.* & Bobocioiu E.: THE WURM PROJECT: COMPUTATIONAL MINERAL PHYSICS, RAMAN SPECTRA, AND A WINDOW TO NEW LOW-TEMPERATURE MINERALOGY

14-17    Panel number 39

Comodi P.*, Nazzareni S., Guidoni F., Balic-Zunic T. & Prakapenka V.: HIGH PRESSURE BEHAVIOUR OF CHALCOSTIBITE

14-18    Panel number 40

Hernández-Laguna A.*, Sainz-Díaz C.I., Hernández-Haro N., Muñoz-Santiburcio D., Pérez Del Valle C., Ortega-Castro J. & Mookherjee M.: ENERGETICS AND COMPRESSIBILITY OF 2M₁ MUSCOVITE-PHLOGOPITE SOLID-SOLUTION SERIES TO 9 GPa

14-19    Panel number 41

McCammon C.A.*, Chariton S., Cerantola V., Kupenko I., Vasiukov D.M., Aprilis G., Chumakov A. & Dubrovinsky L.: A NUCLEAR INELASTIC SCATTERING WINDOW TO THE DEEP EARTH

14-20    Panel number 42

Merlini M.*, Lotti P., Gatta G.D., Crichton W., Hanfland M., Plaisier J.R. & Lausi A.: CANDIDATE CARBONATE PHASES IN THE EARTH

14-21    Panel number 43

Mookherjee M.*, Hermann A. & Wunder B.: HIGH-PRESSURE ELASTICITY OF PHASE-Pi, Al₃Si₂O₇(OH)₃

14-22    Panel number 44

Pedone A., Muniz-Miranda F., Lodesani F., Malferrari D.* & Brigatti M.F.: SEPIOLITE AND PALYGORSKITE INTERACTION WITH CARBON DIOXIDE: EXPERIMENTAL EVIDENCE AND MOLECULAR DYNAMICS SIMULATION

14-23    Panel number 45

Ridolfi F., Oberti R., Zanetti A., Renzulli A.* & Perugini D.: AMFORM.XLSX - A NEW MODEL FOR AMPHIBOLE FORMULA CALCULATION FROM EMP ANALYSES

14-24    Panel number 46

Sun X.-Y., Cordier P.*, Taupin V., Fressengeas C. & Karki B.B.: INFLUENCE OF PRESSURE ON DISCLINATION STRUCTURES AND GRAIN-BOUNDARY MIGRATION OF A {310}/[001] BOUNDARY IN MgO

14-25    Panel number 47

Zucchini A.*, Prencipe M., Belmonte D. & Comodi P.: DOLOMITE TO DOLOMITE-II: A HIGH PRESSURE AB-INITIO STUDY