R_test_data_with_results.csv

Sample.ID,HS.mCO2.before,HS.mCO2.after,Temp.insitu,Temp.equil,Alkalinity.measured,Volume.gas,Volume.water,Bar.pressure,Constants,Salinity,mCO2 complete headspace (ppmv),pCO2 complete headspace (micro-atm),CO2 concentration complete headspace (micro-mol/L),pH,mCO2 simple headspace (ppmv),pCO2 simple headspace (micro-atm),CO2 concentration simple headspace (micro-mol/L),% error,pCO2_in_situ_NDIR (ppmv)
Parker105,391.5,506,24.55,29,789.3413,20,10,90.5,2,0,665.644418961215,594.530667811399,22.8874287745816,7.86552643090978,718.764323716806,641.975537097172,24.713896483127,7.98022235933239,564
Parker106,391.5,496,24.29,29.2,789.3413,20,10,90.5,2,0,627.951721608984,560.864848809406,21.7451649242342,7.8866634191189,679.180996846659,606.621072929905,23.5191691998143,8.15815507383451,508
Parker107,391.5,601,22.42,26.5,789.3413,20,10,90.5,2,0,953.757743876047,851.863565958868,34.7871465273835,7.69702720603732,1004.89774778058,897.540055999435,36.6524155861785,5.36194900989263,884
Parker108,391.5,1949,15.5,23.1,789.3413,20,10,90.5,2,0,4397.60764100939,3927.79167541425,197.076564577255,6.96463215094686,4415.64553833302,3943.90250401321,197.884923832316,0.41017523153775,4147
Parker109,391.5,2896,11.1,22.4,789.3413,20,10,90.5,2,0,6027.6222326313,5383.66456504449,311.62167145695,6.77006578317423,6039.32849213755,5394.12019282949,312.22687264791,0.194210238373496,6009
Parker110,391.5,3388,8.52,21.8,789.3413,20,10,90.5,2,0,6601.64703910906,5896.36375069696,372.832596887953,6.69597960528612,6611.29145164346,5904.97780778419,373.377271777319,0.146091005430509,6853
Parker111,391.5,2967,7.55,22.1,789.3413,20,10,90.5,2,0,5496.9316657741,4909.67002963292,321.221435624162,6.75875765937756,5507.01188347255,4918.67333288197,321.810488244311,0.183378988704094,5595
Parker112,391.5,2455,7.13,19.5,789.3413,20,10,90.5,2,0,4529.75964709136,4045.82529545293,268.686040419628,6.85337617789944,4539.53024619886,4054.55205804093,269.265590724998,0.215697959024808,4618
Waterloo113,395,512,24.6,23.4,935.2844,10.6755,15,90.5,2,0,607.080495361859,542.223388406102,20.8453797882571,8.00810109084487,628.818580370144,561.639097197118,21.5918024477382,3.58075826424419,666
Waterloo114,395,498,21.86,25.2,935.2844,20,10,90.5,2,0,631.841509021652,564.339072948034,23.4137598967195,7.94784549573458,681.087837815293,608.32419760458,25.238650635466,7.79409521066358,537
Waterloo115,395,503,21.81,26.1,935.2844,20,10,90.5,2,0,631.470738925821,564.007913869102,23.4333130075209,7.94266032178282,684.066959320116,610.985046320952,25.3851115938,8.32916193136114,553
Waterloo116,395,470,21.82,26.9,935.2844,20,10,90.5,2,0,528.434810274395,471.979771328228,19.6041650910773,8.01523473916033,573.305668847205,512.05687669057,21.2688088695274,8.49127606667514,527
Waterloo117,395,495,21.8,28.3,935.2844,20,10,90.5,2,0,576.719883147564,515.106335305744,21.4076470919747,7.97058757026474,633.065262087497,565.432087035958,23.4991685096627,9.76997335906241,518
Waterloo118,395,491,21.83,26.6,935.2844,20,10,90.5,2,0,590.439050548943,527.35982309084,21.8982038842478,7.96920890215201,641.342301205314,572.824853284786,23.7861036771355,8.62125406662121,513
Waterloo119,395,517,21.76,25.9,935.2844,20,10,90.5,2,0,673.996949915805,601.990860768619,25.0470358360839,7.91505106432413,728.829693575278,650.965578766964,27.0847270980416,8.13545872371119,551
Waterloo120,395,635,21.55,26.2,935.2844,20,10,90.5,2,0,1016.49096006029,907.894713895444,38.0016645906335,7.73372033884688,1081.37760795801,965.84923286652,40.4274615004985,6.38339645380405,991
Leclerc121,385.4,659,25.8,26.5,614.2952,10.6755,15,90.5,2,0,865.781302120819,773.286038410404,28.7822175407501,7.67049714265684,885.079806798125,790.522798077773,29.4237811301609,2.22902765745022,1142
Leclerc122,385.4,739,23.03,27.9,664.9796,20,10,90.5,2,0,1404.80733825064,1254.72552787252,50.3697516958243,7.45587548147171,1446.85786354941,1292.28360869698,51.8774847922472,2.99333041291904,1210
Leclerc123,385.4,774,20.75,26.8,669.7949,20,10,90.5,2,0,1443.70117426177,1289.46416255307,55.2284753451539,7.4245279484347,1480.47378323943,1322.30819031008,56.6352035272088,2.54710667506837,1306
Memphrémagog124,402,445,23.19,25.9,1211.616,20,10,90.5,2,0,471.200222933255,420.859809281614,16.8198510425882,8.19712966134199,511.513237432271,456.866005305902,18.2588548162498,8.55538952169096,354
Memphrémagog125,402,401,22.85,25.8,1211.616,20,10,90.5,2,0,368.780660012963,329.382183381921,13.2894037038071,8.29815662862379,367.67055353634,328.390674513089,13.2493998350534,-0.301020795554714,325
Memphrémagog126,402,409,22.81,26.2,1211.616,20,10,90.5,2,0,381.085510885795,340.372452357903,13.7482064318116,8.28157482393547,388.698678433625,347.172271386559,14.0228623713781,1.99775833254167,313
Memphrémagog127,402,394,22.8,26.1,1211.616,20,10,90.5,2,0,351.220691812201,313.698224613907,12.6743388056272,8.3167144795942,342.022407208282,305.482633627926,12.3424045596717,-2.61894723698018,308
Memphrémagog128,402,375,20.8,25.3,1211.616,20,10,90.5,2,0,303.862624041823,271.399629664791,11.607405889161,8.35840792742948,273.034839638662,243.865314456441,10.429799372534,-10.1453031613781,289
Memphrémagog129,402,396,20.73,25.5,1211.616,20,10,90.5,2,0,340.25073999523,303.900241495863,13.0237515868336,8.30837522265092,333.912819971514,298.239429631601,12.7811555061689,-1.86272042312227,300
Memphrémagog130,402,401,20.6,24.9,1211.616,20,10,90.5,2,0,354.349954264719,316.493174053364,13.6145929644321,8.29280374926258,353.337919258737,315.589259244171,13.5757092436742,-0.285603255708768,306
Memphrémagog131,402,471,20,25.2,1211.616,20,10,90.5,2,0,499.774625010472,446.381481011081,19.5405707727071,8.1367656060114,551.140685725602,492.259877208655,21.5489203256644,10.277844881391,432
Gilbert132,387,369,25.1,24.4,1019.098,10.6755,15,90.5,2,0,367.337877288447,328.093539547046,12.4435227202645,8.26009744278582,360.590948347762,322.067415005897,12.2149713816844,-1.83670929621751,322
Gilbert133,387,420,24.47,24,1019.098,20,10,90.5,2,0,477.4513176652,426.443071785844,16.4524535748614,8.1430222280119,503.988846650724,450.145478627096,17.3669079861739,5.55816436224248,316
Gilbert134,387,393,24.45,23.9,1019.098,20,10,90.5,2,0,407.719489501714,364.161004686949,14.0572366173366,8.21092844418734,413.246079631734,369.097164635301,14.2477808202632,1.35548833752684,310
Gilbert135,387,375,23.93,23.6,1019.098,20,10,90.5,2,0,362.060862160105,323.380291393925,12.6621131664175,8.25733299240765,350.24596876032,312.827635556959,12.2489187758813,-3.26323406769127,315
Gilbert136,387,316,21.59,22.5,1019.098,20,10,90.5,2,0,235.2206760856,210.091006027602,8.78372152875964,8.41957319867682,151.210827215443,135.056302620257,5.64658609309707,-35.7153334767157,214
Gilbert137,387,308,16.73,20.5,1019.098,20,10,90.5,2,0,202.507205264437,180.872460660563,8.73471238711801,8.43498538372291,123.133214244302,109.978345809123,5.31108614293952,-39.1956379608751,176
Gilbert138,387,661,13.94,19,1019.098,20,10,90.5,2,0,1009.3851532419,901.548051994982,47.53366775139,7.71829085927578,1050.65230547814,938.406450982202,49.4770083059281,4.08834547483721,884
Gilbert139,387,1744,11.64,17.6,1019.098,20,10,90.5,2,0,3663.22037458883,3271.86226400483,185.994739958936,7.1374869615222,3683.08930139229,3289.60850506787,187.003556108712,0.542389612737576,3436
Gilbert140,387,3076,9.93,17.9,1019.098,20,10,90.5,2,0,6553.8943048383,5853.71265322345,352.532805762967,6.85782580933274,6566.39897925735,5864.88139770826,353.205429969746,0.190797621039156,6495
Stukely141,393,339,24.1,24.2,1019.098,10.6755,15,90.5,2,0,314.737577076122,281.112763142255,10.9558273231865,8.31549520177759,292.823099467008,261.539506555778,10.1929974291722,-6.96277762976303,340
Stukely142,393,386,23.25,24.5,492.4445,20,10,90.5,2,0,359.606021293724,321.187712085685,12.8150036857873,7.9347196357088,356.857807211425,318.733101925823,12.7170676905354,-0.76422916179531,309
Stukely143,393,380,23.02,25,492.4445,20,10,90.5,2,0,335.755081636203,299.884874296337,12.0419501354178,7.95866856907161,330.251205995455,294.969002147433,11.8445520924919,-1.63925311686304,290
Stukely144,393,403,23.02,24.8,492.4445,20,10,90.5,2,0,403.09599024698,360.031454402681,14.4571507024888,7.88113769445792,406.545999330111,363.112883684925,14.5808862455023,0.855877797498713,287
Stukely145,393,394,22.94,26.2,492.4445,20,10,90.5,2,0,362.394669365036,323.678436491841,13.0264543419235,7.91840046721527,362.798118788262,324.038783620406,13.0409565295526,0.111328741102159,289
Stukely146,393,417,21.32,27.1,492.4445,20,10,90.5,2,0,399.57491721231,356.886553246622,15.0368060681284,7.85202277803933,407.71209986591,364.154404518774,15.3430245824354,2.03645982344693,308
Stukely147,393,558,16.73,24,492.4445,20,10,90.5,2,0,748.518684757396,668.551107530662,32.2857422243428,7.53879732204012,765.330350850052,683.56670862995,33.0108772528761,2.24599150762749,857
Stukely148,393,829,13.16,21.8,492.4445,20,10,90.5,2,0,1370.47786221733,1224.06362231106,66.1873142476294,7.24117991001216,1383.18634730136,1235.41440346186,66.8010713312402,0.927303200904178,1346
Stukely149,393,971,11.79,23.4,492.4445,20,10,90.5,2,0,1610.0311959183,1438.0244088883,81.3400563908163,7.1420314872691,1622.38695667545,1449.06014881943,81.9642792501533,0.767423686477105,1494
Peasley171,403,515,22.91,24.1,847.5521,20,10,90.5,2,0,711.682893706938,635.650647722457,25.6032494069128,7.87306288597264,753.575237675319,673.067446430954,27.1103533999228,5.88637781500918,639
Peasley172,403,984,18.67,22.8,847.5521,20,10,90.5,2,0,2014.06942835276,1798.8974415586,81.90687082653,7.37798701326725,2049.74931085879,1830.7654836686,83.3578771753614,1.77153190469757,1965
Peasley173,403,2845,13.55,21.4,847.5521,20,10,90.5,2,0,6463.85054268307,5773.2886662997,308.246723177887,6.81195196289513,6477.27143176529,5785.27574216391,308.886735668029,0.207629941218446,6362
Peasley174,403,3764,10.45,21.5,847.5521,20,10,90.5,2,0,7917.070408752,7071.25459651671,418.383042517274,6.67873460607807,7927.57166448088,7080.63395643247,418.93798861416,0.132640676244053,7448
Peasley175,403,3737,8.18,20.2,847.5521,20,10,90.5,2,0,7379.29567368391,6590.9327260636,421.742432424385,6.68380429888862,7388.50007288246,6599.15377839489,422.268483402508,0.124732760490549,7223
Peasley176,403,3838,7.3,20.9,847.5521,20,10,90.5,2,0,7299.66554103558,6519.8098343323,430.370763436928,6.67035934392407,7308.76180733531,6527.93430608286,430.90705746983,0.124612096932363,7218
Orford177,399,322,23.4,23.3,866.0733,10.6755,15,90.5,2,0,286.931608394572,256.27742965417,10.1826542359459,8.28255603245966,259.415245226885,231.700761836004,9.20615111196117,-9.58986823433132,366
Orford178,399,421,22.47,27.9,866.0733,20,10,90.5,2,0,395.893626566034,353.598551238353,14.4194172560772,8.10898750407912,412.555544257978,368.480402224002,15.0262851806016,4.20868550890017,310
Orford179,399,394,22.38,27.3,866.0733,20,10,90.5,2,0,337.954056372906,301.848922790506,12.3403638705207,8.17852402850303,333.685040500407,298.035984853559,12.1844811159207,-1.26319415080141,292
Orford180,399,405,22.32,27.1,866.0733,20,10,90.5,2,0,364.212526404131,325.30208378558,13.3217144629499,8.14681920537463,368.988073899757,329.56743832152,13.4963885214428,1.31119803669973,290
Orford181,399,407,22.29,27.3,866.0733,20,10,90.5,2,0,366.649255416141,327.478486209334,13.4222023389716,8.1426022432095,372.994308665475,333.145669225023,13.6544804284701,1.7305512436218,301
Orford182,399,408,22.23,27.2,866.0733,20,10,90.5,2,0,369.324236689996,329.867687347098,13.5430589949661,8.13926781058419,376.381509482849,336.171000327637,13.8018480271557,1.91086099739943,299
Orford183,399,353,19.08,25.8,866.0733,20,10,90.5,2,0,240.863341819323,215.130840707118,9.67637102853189,8.29000768863487,198.75831952426,177.52408504264,7.98485660041582,-17.4808760756326,207
Orford184,399,419,15.83,25.7,866.0733,20,10,90.5,2,0,340.253557812697,303.902758273368,15.0915432369579,8.10070181090622,351.665892626362,314.095862646788,15.5977238199979,3.35406773907942,311
Orford185,399,527,12.68,23.3,866.0733,20,10,90.5,2,0,564.363732132208,504.070246809424,27.6866814960111,7.85334535057172,596.800614150318,533.041752584296,29.2779772686259,5.74751355753518,458
Orford186,399,699,10.55,22.8,866.0733,20,10,90.5,2,0,914.714225301471,816.991239968252,48.1751432363497,7.61711273393668,948.057550426265,846.772349504831,49.9312320993318,3.64521773057645,804
Brome187,398.3,494,23.3,22.6,866.0733,10.6755,15,90.5,2,0,566.792567180787,506.239598616938,20.1703014645879,7.99400466370256,582.619893470763,520.3760213087,20.7335444588196,2.79243716421695,574
Brome188,398.3,481,22.86,22.5,789.3413,20,10,90.5,2,0,644.999910265662,576.091703716185,23.2367559715226,7.89370720952509,675.128021616487,603.001095053462,24.3221508067771,4.67102566547881,534
Brome189,398.3,534,22.83,22.1,789.3413,20,10,90.5,2,0,819.427051935052,731.884018752748,29.5454589960354,7.7925917374714,855.774513846538,764.348319793848,30.8560118304576,4.43571661756256,529
Brome190,398.3,464,22.82,22.1,789.3413,20,10,90.5,2,0,598.069421301744,534.175007429636,21.5701722923165,7.92826262538393,623.88075120444,557.228798263033,22.5010923715995,4.31577488889426,534
Brome191,398.3,466,22.76,22.3,789.3413,20,10,90.5,2,0,600.127543689323,536.013251457032,21.6808055226196,7.92480833492747,626.659289498958,559.710492964774,22.639317804089,4.421017846728,539
Brome192,398.3,529,22.67,23.5,789.3413,20,10,90.5,2,0,774.724746047274,691.957458843112,28.0592036405784,7.80634965371714,813.39411604209,726.495608209318,29.4597420032335,4.99136889483804,618
Brome193,398.3,610,22.1,22.1,789.3413,20,10,90.5,2,0,1045.77750730521,934.05244915985,38.4897681107914,7.67834870329268,1084.8293171092,968.932180590994,39.9270672429322,3.73423692240374,896
Brome194,398.3,662,22.08,22.7,789.3413,20,10,90.5,2,0,1199.70507507154,1071.53525086577,44.1800785055696,7.61502319962814,1240.45976398853,1107.93593526732,45.6809018272641,3.39705897422801,1069
Choiniere Reservoir195,378,250,24.02,25,922.1071,20,10,90.5,2,0,149.966076836545,133.944534455537,5.23170556240292,8.58061816045408,-56.5307892592071,-50.4913538411867,-1.97212896978545,-137.695717892802,140
Choiniere Reservoir196,378,199,22.09,23.8,922.1071,20,10,90.5,2,0,101.928567011611,91.0390852657374,3.75253629458892,8.7258105505666,-209.358175563998,-186.9915113599,-7.70759538180623,-305.396957596931,107
Choiniere Reservoir197,378,271,21.79,22,922.1071,20,10,90.5,2,0,173.348241532593,154.828678595605,6.4364592178748,8.51177263499354,31.4160497105912,28.0597335189588,1.16648499552808,-81.876914681777,149
Choiniere Reservoir198,378,347,21.69,23,922.1071,20,10,90.5,2,0,294.789834509193,263.296126553979,10.9768277629781,8.27913343520317,265.894976669702,237.488234775308,9.90089555429837,-9.80185015117575,251
Choiniere Reservoir199,378,495,21.6,23.2,922.1071,20,10,90.5,2,0,682.963690745033,609.999644830254,25.4962741617045,7.91650499371708,730.934440681663,652.845466387274,27.2871093242483,7.02390926292145,589
Choiniere Reservoir200,378,599,21.32,23.3,922.1071,20,10,90.5,2,0,993.453237803759,887.318213878512,37.3856391658139,7.75080573024755,1049.27687873963,937.17796719404,39.4863948104017,5.61915134116193,845
Choiniere Reservoir201,378,1985,19.72,23.1,922.1071,20,10,90.5,2,0,5129.70989533071,4581.68019272074,202.219362213499,7.02089747659388,5155.74457304643,4604.93347012783,203.245680666303,0.507527291931706,5324
Choiniere Reservoir202,378,2255,16.48,22.4,922.1071,20,10,90.5,2,0,5433.72023083981,4853.21175318039,236.186962627586,6.957781642191,5454.39870964427,4871.68105820682,237.085791955026,0.38055840061656,5353
Choiniere Reservoir203,378,2249,12.81,20.1,922.1071,20,10,90.5,2,0,4961.75166325209,4431.66568491798,242.380544945418,6.96142024947834,4978.17380379431,4446.33337521229,243.182763122372,0.330974656870629,5407