From 0b15bed5179d3f6d45a81f8484c87a2e945da113 Mon Sep 17 00:00:00 2001 From: Jeffrey Dick Date: Sun, 19 May 2024 01:31:37 +0000 Subject: [PATCH] Correct V for tripropylaminium git-svn-id: svn://scm.r-forge.r-project.org/svnroot/chnosz/pkg/CHNOSZ@841 edb9625f-4e0d-4859-8d74-9fd3b1da38cb --- DESCRIPTION | 4 ++-- inst/extdata/OBIGT/organic_aq.csv | 2 +- inst/extdata/OBIGT/refs.csv | 1 + 3 files changed, 4 insertions(+), 3 deletions(-) diff --git a/DESCRIPTION b/DESCRIPTION index 1337f7c..f7b215b 100644 --- a/DESCRIPTION +++ b/DESCRIPTION @@ -1,6 +1,6 @@ -Date: 2024-05-17 +Date: 2024-05-19 Package: CHNOSZ -Version: 2.1.0-13 +Version: 2.1.0-14 Title: Thermodynamic Calculations and Diagrams for Geochemistry Authors@R: c( person("Jeffrey", "Dick", , "j3ffdick@gmail.com", role = c("aut", "cre"), diff --git a/inst/extdata/OBIGT/organic_aq.csv b/inst/extdata/OBIGT/organic_aq.csv index 378f71b..22aa536 100644 --- a/inst/extdata/OBIGT/organic_aq.csv +++ b/inst/extdata/OBIGT/organic_aq.csv @@ -1064,7 +1064,7 @@ propylaminium,NA,C3H10N+,aq,RSS+24,NA,2024-04-17,HKF,J,-28480,-183900,179.8,294. dipropylamine,NA,C6H15N,aq,RSS+24,NA,2024-04-17,HKF,J,78070,-188700,215.6,652,123.06,102.5838,75.389,121.6295,-49.7511,614.789,15.1552,-0.6986,0 dipropylaminium,NA,C6H16N+,aq,RSS+24,NA,2024-04-17,HKF,J,15280,-243800,241.4,577.2,120.86,103.7074,80.8132,-25.1176,-14.9682,351.2591,104.8789,-1.396,1 tripropylamine,NA,C9H21N,aq,RSS+24,NA,2024-04-17,HKF,J,133060,-239900,268.7,888.91,168.3,141.484,116.7781,-77.2636,-16.4549,522.4594,168.3744,-2.6466,0 -tripropylaminium,NA,C9H22N+,aq,RSS+24,NA,2024-04-17,HKF,J,72250,-283800,325.4,736.91,167.78,141.3889,116.6876,-52.3145,-16.4512,433.1724,137.412,-2.669,1 +tripropylaminium,NA,C9H22N+,aq,RSS+24,RSS+24.1,2024-04-17,HKF,J,72250,-283800,325.4,736.91,168.2,141.3889,116.6876,-52.3145,-16.4512,433.1724,137.412,-2.669,1 butylamine,NA,C4H11N,aq,RSS+24,NA,2024-04-17,HKF,J,39460,-151000,198.7,422.6,89.8,75.3091,53.8404,80.981,-34.2705,390.8771,12.8498,-0.6094,0 butylaminium,NA,C4H12N+,aq,RSS+24,NA,2024-04-17,HKF,J,-21280,-209500,206.2,413.4,85.5,75.3034,53.7714,-2.3667,-13.8502,259.8919,71.4233,-0.8637,1 dibutylamine,NA,C8H19N,aq,RSS+24,NA,2024-04-17,HKF,J,97630,-235700,265.2,846.98,155.4,129.0434,96.4991,162.3664,-65.1189,806.2203,16.6294,-0.7584,0 diff --git a/inst/extdata/OBIGT/refs.csv b/inst/extdata/OBIGT/refs.csv index c94fa88..6e6137d 100644 --- a/inst/extdata/OBIGT/refs.csv +++ b/inst/extdata/OBIGT/refs.csv @@ -291,3 +291,4 @@ NEA20,"Grenthe et al.",2020,"Second Update on the Chemical Thermodynamics of Ura NEA20.1,"Grenthe et al.",2020,"Second Update on the Chemical Thermodynamics of Uranium, Neptunium, Plutonium, Americium and Technetium","UO3",https://doi.org/10.1787/bf86a907-en MBA+24,"A. Migdisov, E. Bastrakov et al.",2024,"Geochim. Cosmochim. Acta","uranyl-carbonate, -chloride, -sulfate, and -hydroxide complexes",https://doi.org/10.1016/j.gca.2024.04.023 RSS+24,"K. Robinson et al.",2024,"Geochim. Cosmochim. Acta 372, 62-80","alkylamines, benzylamines, and aminiums",https://doi.org/10.1016/j.gca.2024.03.013 +RSS+24.1,"K. Robinson et al.",2024,"Geochim. Cosmochim. Acta 372, 62-80","corrected V for tripropylaminium",https://doi.org/10.1016/j.gca.2024.03.013