[CHNOSZ-commits] r535 - pkg/CHNOSZ/inst/extdata/OBIGT

noreply at r-forge.r-project.org noreply at r-forge.r-project.org
Tue Jun 30 16:45:56 CEST 2020 

Author: jedick
Date: 2020-06-30 16:45:56 +0200 (Tue, 30 Jun 2020)
New Revision: 535

Modified:
   pkg/CHNOSZ/inst/extdata/OBIGT/DEW_aq.csv
   pkg/CHNOSZ/inst/extdata/OBIGT/refs.csv
Log:
OBIGT/DEW: update references and round omega values


Modified: pkg/CHNOSZ/inst/extdata/OBIGT/DEW_aq.csv
===================================================================
--- pkg/CHNOSZ/inst/extdata/OBIGT/DEW_aq.csv	2020-06-30 08:05:21 UTC (rev 534)
+++ pkg/CHNOSZ/inst/extdata/OBIGT/DEW_aq.csv	2020-06-30 14:45:56 UTC (rev 535)
@@ -14,7 +14,7 @@
 Be+2,Be(+2),Be+2,aq,SH88,DEW17.2,26.Sep.17,cal,-83500,-91500,-55.7,-1.3,-25.4,-1.4187,-9.4791,9.9786,-2.3871,22.9154,-3.2995,1.9007,2
 benzene,BENZENE,C6H6,aq,PS01,DEW17.3,26.Sep.17,cal,32000,12230,35.7,89.12,83,17.5199,12.3976,-5.5571,-3.2915,66.9,9.8,-0.25,0
 BO(OH),BO(OH)(0),BO(OH),aq,SH88,SHA14.2,26.Sep.17,cal,-174854,-188505,24,3.76,20.49,5.54,1.38,3.1,-2.84,25,-10,0.1,0
-BO2-,BO2(-),BO2-,aq,SH88,SHA14.2,26.Sep.17,cal,-162240,-184600,-8.9,-9,-16.02,-0.855,-2.596,3.7,-2.6717,17.102,-4.8679,1.7595,-1
+BO2-,BO2(-),BO2-,aq,SH88,SHA14.4,26.Sep.17,cal,-162240,-184600,-8.9,-9,-16.02,-0.855,-2.596,3.7,-2.6717,17.102,-4.8679,1.7595,-1
 Ca(HCO3)+,Ca(HCO3)(+),Ca(HCO3)+,aq,FDM+14,DEW17.03,26.Sep.17,cal,-273830,-294350,16,90.95,37.51,9.14,4.42,1.13,-2.96,65.9,15.5,0.7,1
 CaOH+,Ca(OH)(+),Ca(OH)+,aq,SSWS97,DEW17.3,26.Sep.17,cal,-171300,-179600,6.7,1.4,1.9,2.1051,-2.2789,6.749,-2.6848,11.1292,-2.7494,0.4496,1
 CaCl+,CaCl(+),CaCl+,aq,SSH97,DEW17.5,26.Sep.17,cal,-163100,-168607,4.5,17.5,11.3,3.9392,-0.5326,5.2847,-2.757,20.7297,0.5302,0.4675,1
@@ -47,7 +47,7 @@
 Eu+3,Eu(+3),Eu+3,aq,SSWS97,DEW17.2,26.Sep.17,cal,-137300,-144700,-53,-36.6,-41.3,-8.1578,-2.214,13.8765,-2.6875,6.0547,-10.49,2.3161,3
 Fe(Ac)+,Fe(CH3COO)(+),Fe(CH3COO)+,aq,SSWS97,DEW17.6,26.Sep.17,cal,-111900,-139060,-1.5,81.2,25.2,6.6906,2.087,3.0882,-2.8653,59.0576,13.5058,0.5756,1
 Fe(Ac)2,Fe(CH3COO)2(0),Fe(CH3COO)2,aq,SSWS97,DEW17.6,26.Sep.17,cal,-201800,-259100,11.53,184.2,66.9,14.4948,9.5174,-3.1421,-3.1724,113.7691,34.4869,-0.038,0
-FeOH+,FeOH(+),FeOH+,aq,SSWS97,DEW17.13,26.Sep.17,cal,-65850,0,-10,15,2,2.2461,-2.1446,6.6364,-2.6903,21.4354,0.0209,0.70314,1
+FeOH+,FeOH(+),FeOH+,aq,SSWS97,DEW17.13,26.Sep.17,cal,-65850,0,-10,15,2,2.2461,-2.1446,6.6364,-2.6903,21.4354,0.0209,0.7031,1
 Fe+2,Fe(+2),Fe+2,aq,SSWS97,DEW17.2,26.Sep.17,cal,-21870,,-25.3,-7.9,-22.2,-0.9153,-9.3356,9.6131,-2.3931,14.9634,-4.6439,1.4574,2
 Fe+3,Fe(+3),Fe+3,aq,SSWS97,DEW17.2,26.Sep.17,cal,-4120,-11850,-66.3,-18.6,-37,-6.3271,-3.5568,12.7493,-2.632,19.0461,-6.8234,2.5812,3
 FeCl+,FeCl(+),FeCl+,aq,SSWS97,DEW17.6,26.Sep.17,cal,-53030,-61260,-10.06,20.57,5.8,2.9827,-1.4433,6.0483,-2.7193,24.6737,1.1555,0.7003,1
@@ -85,7 +85,7 @@
 HCO3-,HCO3(-),HCO3-,aq,FDM+14,DEW17.03,26.Sep.17,cal,-140282,-164898,23.53,-8.45,24.23,7.65,0.92,0.6,-2.82,11,-3.8,1.2733,-1
 HCrO4-,HCrO4(-),HCrO4-,aq,SSWS97,DEW17.3,26.Sep.17,cal,-182800,-209900,44,20.4,44,10.5272,5.7398,0.0253,-3.0163,26.9871,1.121,0.9622,-1
 hexane,HEXANE,C6H14,aq,PS01,DEW17.3,26.Sep.17,cal,4420,-47400,53.2,159.07,114,23.4349,18.0292,-10.2792,-3.5243,108,23,-0.47,0
-HFeO2-,HFeO2(-),HFeO2-,aq,SSWS97,DEW17.13,26.Sep.17,cal,-94400,,-15,22,20,6.295,1.7103,3.404,-2.8497,36.1614,1.4468,1.85626,-1
+HFeO2-,HFeO2(-),HFeO2-,aq,SSWS97,DEW17.13,26.Sep.17,cal,-94400,,-15,22,20,6.295,1.7103,3.404,-2.8497,36.1614,1.4468,1.8563,-1
 Hg+2,Hg(+2),Hg+2,aq,SSWS97,DEW17.2,26.Sep.17,cal,39360,40670,-8.68,2.2,-19.6,-0.4745,-9.2099,9.293,-2.3983,18.0614,-2.5866,1.1512,2
 Hg2+2,Hg2(+2),Hg2+2,aq,SSWS97,DEW17.3,26.Sep.17,cal,36710,39870,-15.66,17.1,14.4,4.7103,0.2016,4.6691,-2.7873,23.7435,0.4486,0.8201,2
 Ho+3,Ho(+3),Ho+3,aq,SSWS97,DEW17.2,26.Sep.17,cal,-161400,-169000,-54.3,-33.3,-41.6,-8.2013,-2.1821,13.9033,-2.6888,8.6686,-9.8178,2.3899,3
@@ -112,8 +112,8 @@
 Lu+3,Lu(+3),Lu+3,aq,SSWS97,DEW17.1,26.Sep.17,cal,-159400,-167900,-63.1,-32.8,-45,-9.398,-1.3044,14.6401,-2.7251,9.5649,-9.716,2.4554,3
 CH4,,CH4,aq,PS01,DEW17.3,26.Sep.17,cal,-8234,-21010,20.99,57.69,36,8.32,3.64,1.79,-2.93,40.9,6.45,-0.4,0
 methanol,METHANOL,CH3OH,aq,PS01,DEW17.01,26.Sep.17,cal,-42050,-58870,31.6,37.73,38.69,8.4,4.1,-0.24,-1.43,34.4,0.96,-0.15,0
-Mg(HCO3)+,Mg(HCO3)(+),Mg(HCO3)+,aq,SBS14,DEW17.26,26.Sep.17,cal,-250280,-275750,-5,59,25.9,6.8514,2.2401,2.9598,-2.8716,46.5246,8.9837,0.62742,1
-Mg(HSiO3)+,Mg(HSiO3)(+),Mg(HSiO3)+,aq,SSWS97,DEW17.4,26.Sep.17,cal,-353025,-385700,-23.78,37.82,2.5,2.4433,-1.9569,6.4789,-2.6981,36.7319,4.6693,0.91182432,1
+Mg(HCO3)+,Mg(HCO3)(+),Mg(HCO3)+,aq,SBS14,DEW17.26,26.Sep.17,cal,-250280,-275750,-5,59,25.9,6.8514,2.2401,2.9598,-2.8716,46.5246,8.9837,0.6274,1
+Mg(HSiO3)+,Mg(HSiO3)(+),Mg(HSiO3)+,aq,SSWS97,DEW17.4,26.Sep.17,cal,-353025,-385700,-23.78,37.82,2.5,2.4433,-1.9569,6.4789,-2.6981,36.7319,4.6693,0.9118,1
 MgCl+,MgCl(+),MgCl+,aq,SSWS97,DEW17.6,26.Sep.17,cal,-139700,-150933,-19,25,1.25,3.21,-4.92,6.27,-2.58,28.6,2.058,0.8449,1
 MgCO3,MgCO3(0),MgCO3,aq,SSWS97,DEW17.27,26.Sep.17,cal,-238760,-270570,-24,-24.8,17.9,5.1407,0.6113,4.3256,-2.8043,-5.6039,-8.0864,0.3,0
 MgOH+,MgOH(+),MgOH+,aq,SSWS97,DEW17.28,26.Sep.17,cal,-149225,-152955,-17,40,-7,0.5662,-3.7441,7.9775,-2.6242,37.393,5.1134,0.8449,1
@@ -126,9 +126,9 @@
 MoO4-2,MoO4(-2),MoO4-2,aq,SSWS97,DEW17.1,26.Sep.17,cal,-199900,-238500,6.5,-47.5,30.4,12.64,-5.4721,-0.2288,-2.5528,7.0223,-12.7103,3.1145,-2
 N2,N2(0),N2,aq,SHS89,DEW17.3,26.Sep.17,cal,4347,-2495,22.9,56,33.3,7.8213,3.1635,2.1855,-2.9098,35.7911,8.3726,-0.3468,0
 Na(Ac),NaCH3COO(0),NaCH3COO,aq,SK93,DEW17.3,26.Sep.17,cal,-150720,-173540,34.2,75.1,49,11.1806,6.3619,-0.4963,-3.042,52.9437,12.2633,0.3,0
-Na(Ac)2-,Na(CH3COO)2(-1),Na(CH3COO)2-1,aq,SK93,DEW17.3,26.Sep.17,cal,-238470,-292400,44,170,103.2,22.0247,16.6865,-9.1534,-3.4688,114.6669,31.5944,0.962764,-1
+Na(Ac)2-,Na(CH3COO)2(-1),Na(CH3COO)2-1,aq,SK93,DEW17.3,26.Sep.17,cal,-238470,-292400,44,170,103.2,22.0247,16.6865,-9.1534,-3.4688,114.6669,31.5944,0.9628,-1
 NaCl,NaCl(0),NaCl,aq,SSWS97,DEW17.3,26.Sep.17,cal,-92910,-96120,28,8.51,24,6.1632,1.5849,3.5092,-2.8445,10.8029,-1.3014,-0.038,0
-NaCO3-,NaCO3(-),NaCO3-,aq,SBS13,DEW17.30,26.Sep.17,cal,-190562,,8,-1,27.8,7.6427,2.9935,2.3281,-2.9028,19.473,-3.2383,1.507948,-1
+NaCO3-,NaCO3(-),NaCO3-,aq,SBS13,DEW17.30,26.Sep.17,cal,-190562,,8,-1,27.8,7.6427,2.9935,2.3281,-2.9028,19.473,-3.2383,1.5079,-1
 NaHCO3,NaHCO3(0),NaHCO3,aq,SBS13,DEW17.31,26.Sep.17,cal,-203088,-150000,31,73.9,36.72,9.61,2.56,1.01,-2.88,55.5,12,0.65,0
 NaHSiO3,NaHSiO3(0),NaHSiO3,aq,SSWS97,DEW17.4,26.Sep.17,cal,-307140,-333044,19,2.34,18.7,5.1339,0.6048,4.3309,-2.804,7.188,-2.5579,-0.038,0
 NaOH,NaOH(0),NaOH,aq,HP97,DEW17.32,26.Sep.17,cal,-100900,,6.5,42,12,3.9469,-0.5253,5.2786,-2.7573,32.6238,5.5208,0.2,0

Modified: pkg/CHNOSZ/inst/extdata/OBIGT/refs.csv
===================================================================
--- pkg/CHNOSZ/inst/extdata/OBIGT/refs.csv	2020-06-30 08:05:21 UTC (rev 534)
+++ pkg/CHNOSZ/inst/extdata/OBIGT/refs.csv	2020-06-30 14:45:56 UTC (rev 535)
@@ -192,8 +192,9 @@
 SBS14,"A. Stefánsson, P. Benézéth and J. Schott",2014,"Geochim. Cosmochim. Acta 138, 21-31",Mg(HCO<sub>3</sub>)<sup>+</sup>,https://doi.org/10.1016/j.gca.2014.04.008
 SHA14,"D. A. Sverjensky et al.",2014,"Geochim. Cosmochim. Acta 129, 125-145","SiO<sub>2</sub> and Si<sub>2</sub>O<sub>4</sub>",https://doi.org/10.1016/j.gca.2013.12.019
 SHA14.1,"D. A. Sverjensky et al.",2014,"Geochim. Cosmochim. Acta 129, 125-145","revisions for AlO<sub>2</sub><sup>-</sup> and HAlO<sub>2</sub>",https://doi.org/10.1016/j.gca.2013.12.019
-SHA14.2,"D. A. Sverjensky et al.",2014,"Geochim. Cosmochim. Acta 129, 125-145","revisions for BO(OH) and BO<sub>2</sub><sup>-</sup>",https://doi.org/10.1016/j.gca.2013.12.019
+SHA14.2,"D. A. Sverjensky et al.",2014,"Geochim. Cosmochim. Acta 129, 125-145","BO(OH): Revised May 2013",https://doi.org/10.1016/j.gca.2013.12.019
 SHA14.3,"D. A. Sverjensky et al.",2014,"Geochim. Cosmochim. Acta 129, 125-145","Fitted to @HP97 data with a<sub>1</sub> pred. from the sum of the ions and used to predict the volume",https://doi.org/10.1016/j.gca.2013.12.019
+SHA14.4,"D. A. Sverjensky et al.",2014,"Geochim. Cosmochim. Acta 129, 125-145","BO<sub>2</sub><sup>-</sup>: revised a<sub>1</sub>-a<sub>4</sub> using delkappan for BO<sub>2</sub><sup>-</sup> instead of B(OH)<sub>4</sub><sup>-</sup> used by @SH88; @SSWS97",https://doi.org/10.1016/j.gca.2013.12.019
 PD15,"G. S. Pokrovski and J. Dubessy",2015,"Earth Planet. Sci. Lett. 411, 298-309","trisulfur radical ion",https://doi.org/10.1016/j.epsl.2014.11.035
 SLOP16.1,"E. L. Shock et al.",2016,"slop16.dat computer data file",""Enthalpy changed to be compatible with the equation ΔH=ΔG+TΔS for the formation reaction from elements."",https://doi.org/10.5281/zenodo.2630820
 SLOP16.2,"E. L. Shock et al.",2016,"slop16.dat computer data file","Zn(Ac)<sub>3</sub><sup>-</sup>: "Enthalpy changed to be compatible with the equation ΔH=ΔG+TΔS for the formation reaction from elements. See footnote h in table 2 of @SSH97."",https://doi.org/10.5281/zenodo.2630820
@@ -218,7 +219,7 @@
 CHNOSZ.7,"J. M. Dick",2019,"CHNOSZ package documentation","Tl(Gly) and Tl(Gly)<sub>2</sub><sup>-</sup>: change Ti to Tl",http://chnosz.net
 CHNOSZ.8,"J. M. Dick",2019,"CHNOSZ package documentation","GHS recalculated by adding difference from SiO<sub>2</sub> [@SSH97] to updated values for SiO<sub>2</sub> [@AS04]",http://chnosz.net
 LCT17,"A. R. Lowe, J. S. Cox and P. R. Tremaine",2017,"J. Chem. Thermodynamics 112, 129-145","adenine HKF parameters",https://doi.org/10.1016/j.jct.2017.04.005
-DEW17.01,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","(acetic acid, glycine, methanol, propanoic acid, propanol: parameters in DEW spreadsheet as the same as @PS01)",http://www.dewcommunity.org
+DEW17.01,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","(acetic acid, glycine, methanol, propanoic acid, propanol: parameters in DEW spreadsheet are the same as @PS01)",http://www.dewcommunity.org
 DEW17.02,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","(ethanol: parameters in DEW spreadsheet are different from @PS01; no comment provided)",http://www.dewcommunity.org
 DEW17.03,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","(parameters in DEW spreadsheet are the same as @FDM+14)",http://www.dewcommunity.org
 DEW17.04,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","(Ar, Xe: parameters in DEW spreadsheet are the same as @SHS89)",http://www.dewcommunity.org
@@ -237,28 +238,28 @@
 DEW17.14,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","29/11/16: Fit to @TDDZ00 with revised volume increased in order that a<sub>1</sub> of the complex a bit greater than the sum of the a<sub>1</sub> values of the ions",http://www.dewcommunity.org
 DEW17.15,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","FeCl<sub>2</sub><sup>+</sup>, FeCl<sub>4</sub><sup>-</sup>: 29/11/16: Fit to @LEB+06 with revised volume increased in order that a<sub>1</sub> of the complex a bit greater than the sum of the a<sub>1</sub> values of the ions",http://www.dewcommunity.org
 DEW17.16,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","FeCl<sub>3</sub>: 29/11/16: Fit to @LEB+06 with revised volume increased in order that a<sub>1</sub> of the complex is equal to the sum of the a<sub>1</sub> values of the ions",http://www.dewcommunity.org
-DEW17.17,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","Revised 1/22/15 based on V at 25 C from Ziemer & Woolley (2007) and predicted a<sub>1</sub>, a<sub>2</sub>, and a<sub>4</sub>; c<sub>1</sub> and c<sub>2</sub> from fits to delCpr protonation of Ziemer & Woolley (2007); S from fitting temperature dependence of logK from Ziemer & Woolley (2007); omega predicted from S using ion correlation.",http://www.dewcommunity.org
+DEW17.17,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","Revised 1/22/15 based on V at 25 C from @ZW07 and predicted a<sub>1</sub>, a<sub>2</sub>, and a<sub>4</sub>; c<sub>1</sub> and c<sub>2</sub> from fits to delCpr protonation of @ZW07; S from fitting temperature dependence of logK from @ZW07; omega predicted from S using ion correlation.",http://www.dewcommunity.org
 DEW17.18,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","Revised 1/22/15 based on fitting Cp and V vs T data from @HDM+94 + revised correlation for a<sub>1</sub> from @SHA14; omega from delCPr above 100 °C [@ZW07]; G, H, and S from @AH97b",http://www.dewcommunity.org
-DEW17.19,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","Regression of @RS87 & Tagirov et al. (1997) with new full correlations",http://www.dewcommunity.org
+DEW17.19,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","Regression of @RS87 & @TZA97 with new full correlations",http://www.dewcommunity.org
 DEW17.20,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","Revised late Oct. (2014) to fit @BM77 along Psat. and high pressure logK's from fitting @KUP+05 eclogite solubility measurements.",http://www.dewcommunity.org
 DEW17.21,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","HSO<sub>3</sub><sup>-</sup>: revised using published estimated V and pred. a<sub>1</sub> from new correlation",http://www.dewcommunity.org
-DEW17.22,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","isobutane: G, H, S, Cp, V from Shock & Helgeson (1990); a<sub>1</sub> estimated with Sverjensky et al. (2014); c2 estimated with a new hydrocarbon correlation.",http://www.dewcommunity.org
+DEW17.22,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","isobutane: G, H, S, Cp, V from @SH90; a<sub>1</sub> estimated with @SHA14; c2 estimated with a new hydrocarbon correlation.",http://www.dewcommunity.org
 DEW17.23,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","May, 2017 Fitted to logKs from @OH88 + retrieved logKs from Hemley experiments at 1.0 kb using the HCl referred to above",http://www.dewcommunity.org
 DEW17.25,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","Revised G, S and Cp to fit @Noy07 & @SGX+06 with a<sub>1</sub> of the complex equal to the sum of the a<sub>1</sub> values of the ions",http://www.dewcommunity.org
 DEW17.26,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","Fit to @SBS14 & @SH77; plus revised V increased so that a<sub>1</sub> of the complex is the sum of the a<sub>1</sub> values of the ions",http://www.dewcommunity.org
-DEW17.27,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","MgCO<sub>3</sub>: Sverjensky et al. (1997) revised volume increased in order that a<sub>1</sub> of the complex is the sum of the a<sub>1</sub> values of the ions; and Cp revised using isocoulombic reln with CaCO3,aq; also omega is set to +0.3 as for all neutral metal complexes.",http://www.dewcommunity.org
+DEW17.27,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","MgCO<sub>3</sub>: @SSH97 revised volume increased in order that a<sub>1</sub> of the complex is the sum of the a<sub>1</sub> values of the ions; and Cp revised using isocoulombic reln with CaCO3,aq; also omega is set to +0.3 as for all neutral metal complexes.",http://www.dewcommunity.org
 DEW17.28,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","MgOH<sup>+</sup>: Revised by Dimitri, March, 2015",http://www.dewcommunity.org
 DEW17.29,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","S, Cp, V, omega from fit to @ARHB06 and @FDM94",http://www.dewcommunity.org
 DEW17.30,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","NaCO<sub>3</sub><sup>-</sup>: Fit to @SBS13 (80 to 200 C) & @GTS61 (at 25 C) to get G, S and Cp;  with a<sub>1</sub> pred. from the sum of the ions and used to predict the volume",http://www.dewcommunity.org
 DEW17.31,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","NaHCO<sub>3</sub>: Fit to @SBS13 (80 to 200 C) & @Nak71 (25 C) to get G, S and Cp;  with V, a<sub>1</sub>, and omega from fitting high PT Raman data (Facq et al., 2015)",http://www.dewcommunity.org
-DEW17.32,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","NaOH: Fitted to Ho & Palmer (1997) data with a<sub>1</sub> pred. from the sum of the ions and used to predict the volume",http://www.dewcommunity.org
+DEW17.32,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","NaOH: Fitted to @HP97 data with a<sub>1</sub> pred. from the sum of the ions and used to predict the volume",http://www.dewcommunity.org
 DEW17.33,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","August 16th, 2013 fit to @BL06",http://www.dewcommunity.org
-DEW17.34,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","propane: Shock & Helgeson (1990) with new a<sub>1</sub>-a<sub>4</sub> based on revised correlation to predict a<sub>1</sub> in Sverjensky et al. (2013)",http://www.dewcommunity.org
+DEW17.34,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","propane: @SH90 with new a<sub>1</sub>-a<sub>4</sub> based on revised correlation to predict a<sub>1</sub> in Sverjensky et al. (2013)",http://www.dewcommunity.org
 DEW17.35,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","propanoate: Revised a<sub>1</sub> from new delVn correlation for -1 ions",http://www.dewcommunity.org
-DEW17.36,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","S<sub>3</sub><sup>-</sup>: Regression of data from Pokrovski & Dubessy (2015), Guggenheim (1971); Feb. 2015",http://www.dewcommunity.org
+DEW17.36,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","S<sub>3</sub><sup>-</sup>: Regression of data from @PD15; Feb. 2015",http://www.dewcommunity.org
 DEW17.37,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","fit to Raman speciation and quartz solubility data",http://www.dewcommunity.org
-DEW17.38,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","SO<sub>2</sub>: Shock et al. (1989) with revised a<sub>1</sub> predicted as a complex from delVn",http://www.dewcommunity.org
-DEW17.39,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","toluene: Plyasunov & Shock (2001) with new a<sub>1</sub> to a<sub>4</sub> predicted with revised a<sub>1</sub> consistent with Sverjensky et al. (2013)",http://www.dewcommunity.org
+DEW17.38,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","SO<sub>2</sub>: @SHS89 with revised a<sub>1</sub> predicted as a complex from delVn",http://www.dewcommunity.org
+DEW17.39,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","toluene: @PS01 with new a<sub>1</sub> to a<sub>4</sub> predicted with revised a<sub>1</sub> consistent with @SHA14",http://www.dewcommunity.org
 DEW17.40,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","urea: Revised Feb. 2015 by Dimitri: c1, c2, and omega from PS01 based on Stokes (1967) data; V from Cabani et al. (1981) with a<sub>1</sub>-a<sub>4</sub> predicted.",http://www.dewcommunity.org
 DEW17.101,"D. A. Sverjensky et al.",2017,"Deep Earth Water (DEW) spreadsheet","formate and lactate: revised with new predicted a<sub>1</sub> for ions",https://doi.org/10.1016/0016-7037(90)90429-O
 BDat17.1,"D. A. Sverjensky et al.",2017,"berman.dat file in SUPCRT92b.zip on the DEW website","antigorite: "Oct. 21, 2016: Revised volume coefficients consistent with @HDR06 and @YIY+14 "",http://www.dewcommunity.org/resources.html

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