*********************************************************************************************************************** * * * EOSFIT7c * * * * Authors: RJ ANGEL, J GONZALEZ-PLATAS, M ALVARO, ML MAZZUCCHELLI * * Version date: 13-May-2021 * * Version: 7.60 * * * * * * INCLUDING LEAST SQUARES BY I.G. WOOD & J. PIPER AND USING THE CrysFML EOS MODULE. * * * * EosFit7c: Angel, Gonzalez-Platas, Alvaro (2014) Zeitschrift fuer Kristallographie, 229:405-419. * * Phase Transitions: Angel et al (2017) Contribs Min Pet, DOI:10.1007/s00410-017-1349-x * * Fitting Moduli: Milani et al. (2017) Amer Min, DOI:10.2138/am-2017-5855 * * * * Development currently supported by ERC grant 714936, TrueDepths to M. Alvaro, and * * Agencia Estatal de Investigacion under * * National Program of Sciences and Technological Materials (PID2019-106383GB-C44) to J. Gonzalez-Platas * * For more information see the help system * * * * * * Current date and time: 21-FEB-2025 13:27 * * * *********************************************************************************************************************** EosFit parameter file This is a fixed-format file. If you edit this file, make sure you do not move anything! It is safer to change the parameters by loading the file to EosFit, and saving the file after making changes ____________________________________________________________________________________________________________ Title =BM4-MGD-qcompromise EoS for coesite Savedate =21-FEB-2025 at 13:27 Comment =Source: Angel et al (2022) Reviews in Mineralogy & Geochmistry vol 88, p257-306; doi 10.2138/rmg.2022.88.05 Comment =Parameters obtained by fitting to the following data Comment =group 1: PV data from Angel et al (2000) pressures adjusted to the Scheidel et al (2016) quartz P scale Comment =group 2: TV data of Kulik et al (2018) and Bourova et al (2006) Comment =group 3: Ks-P at room T data of Chen et al (2015) Excluded from fits, not consistent with other data Comment =group 4: Ks-PT data of Chen et al (2017). Scale factor is KReuss to sample K conversion factor System =Monoclinic B-uniqu Model = 2, (Birch-Murnaghan) Order = 4 Thermal = 7, (Mie-Gruneisen-Debye) Cross = 0, (none) Trans = 0, (none) Shear = 0, (none) Angles = 0 Pref = 0.00000 Tref = 298.00000 Pscale =Gpa Vscale =cm^3/mol Osc2 = 0, (none) Osc3 = 0, (none) Type = Volume Stoich = 1.00000 Param = 1 20.6400 (V0 , Reference pressure volume: units are cm^3/mol) Param = 2 101.949 (K0 , Bulk modulus: units are Gpa) Param = 3 2.12406 (Kp , dK/dP: dimensionless) Param = 4 0.29531 (Kpp , d2K/dP2: units are inverse Gpa) Param = 5 0.00000 Param = 6 0.00000 Param = 7 0.00000 Param = 8 0.00000 Param = 9 0.00000 Param =10 0.00000 Param =11 896.692 (ThMGD, Debye temperature in K) Param =12 0.00000 Param =13 3.00000 (Natom, Number of atoms per formula unit) Param =14 1.00000 Param =15 0.00000 Param =16 0.00000 Param =17 0.00000 Param =18 0.27465 (Gamm0, Gruneisen parameter at Tref,Pref) Param =19 0.00000 Param =20 0.00000 Param =21 0.00000 Param =22 0.00000 Param =23 0.00000 Param =24 0.00000 Param =25 0.00000 Param =26 0.00000 Param =27 0.00000 Param =28 0.00000 Param =29 0.00000 Param =30 Inf Param =31 0.00000 Param =32 0.00000 Param =33 0.00000 Param =34 0.00000 Param =35 0.00000 Param =36 0.00000 Param =37 0.00000 Param =38 0.00000 Param =39 0.00000 Param =40 0.00000 Param =41 298.000 Param =42 1.00000 Param =43 0.00000 Param =44 0.00000 Param =45 0.00000 Param =46 298.000 Param =47 1.00000 Param =48 0.00000 Param =49 0.00000 Param =50 1.00000 Param =51 1.00000 Param =52 1.00000 Param =53 1.00458 Param =54 1.05724 Param =55 1.00000 Param =56 1.00000 Param =57 1.00000 Param =58 1.00000 Param =59 1.00000 Variance-Covariance matrix= 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 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