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MDS/cp_output-orig.txt

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2.7 local / 7 search Merge Potential and Acceleration functions. Still need to optimize more
2023-10-16 01:00:45 +01:00
time (s) T(t) (K) P(t) (Pa) Kinetic En. (n.u.) Potential En. (n.u.) Total En. (n.u.)
0.0000e+00 99.823046157131 0.000000000000 2276.129839537671 -21170.987155723102 -18894.857316185429
5.0000e-15 99.430066433986 0.000000000000 2267.169254696612 -21153.065287024074 -18885.896032327462
1.0000e-14 98.775883795075 0.000000000000 2252.252813230883 -21123.229899935293 -18870.977086704410
1.5000e-14 97.862741911230 0.000000000000 2231.431674530326 -21081.582692906752 -18850.151018376426
2.0000e-14 96.694206918839 0.000000000000 2204.787152377213 -21028.285410399832 -18823.498258022621
2.5000e-14 95.275447081837 0.000000000000 2172.437091700281 -20963.572595041518 -18791.135503341236
3.0000e-14 93.613593183031 0.000000000000 2134.544086090446 -20887.768030660878 -18753.223944570433
3.5000e-14 91.718175307735 0.000000000000 2091.325437186824 -20801.304686506606 -18709.979249319782
4.0000e-14 89.601625625826 0.000000000000 2043.064618935748 -20704.747699715772 -18661.683080780025
4.5000e-14 87.279827237114 0.000000000000 1990.123792168963 -20598.819500560676 -18608.695708391711
5.0000e-14 84.772675394773 0.000000000000 1932.956601422036 -20484.425558996321 -18551.468957574285
5.5000e-14 82.104599400629 0.000000000000 1872.120075006427 -20362.678405373808 -18490.558330367381
6.0000e-14 79.304972601851 0.000000000000 1808.283973609195 -20234.916615241480 -18426.632641632285
6.5000e-14 76.408318150720 0.000000000000 1742.235481954568 -20102.714524488580 -18360.479042534011
7.0000e-14 73.454206638373 0.000000000000 1674.876874684737 -19967.877882712844 -18293.001008028106
7.5000e-14 70.486747936098 0.000000000000 1607.213929504612 -19832.420906090741 -18225.206976586131
8.0000e-14 67.553612281810 0.000000000000 1540.333606341292 -19698.521671777577 -18158.188065436283
8.5000e-14 64.704576976476 0.000000000000 1475.370909629343 -19568.455621741428 -18093.084712112086
9.0000e-14 61.989675229269 0.000000000000 1413.466678931913 -19444.510671201177 -18031.043992269264
9.5000e-14 59.457101039628 0.000000000000 1355.719816801386 -19328.891029125971 -17973.171212324585
1.0000e-13 57.151073500535 0.000000000000 1303.138591377119 -19223.619147227324 -17920.480555850205
1.0500e-13 55.109870455531 0.000000000000 1256.595800527268 -19130.445501262071 -17873.849700734805
1.1000e-13 53.364208054286 0.000000000000 1216.791823047155 -19050.774326347972 -17833.982503300816
1.1500e-13 51.936086547624 0.000000000000 1184.228300885332 -18985.610801550443 -17801.382500665113
1.2000e-13 50.838162498530 0.000000000000 1159.193824520485 -18935.532402510558 -17776.338577990075
1.2500e-13 50.073654330447 0.000000000000 1141.761779307151 -18900.684708342607 -17758.922929035456
1.3000e-13 49.636744184237 0.000000000000 1131.799508476207 -18880.799949102369 -17749.000440626161
1.3500e-13 49.513403842570 0.000000000000 1128.987145571103 -18875.234971146470 -17746.247825575367
1.4000e-13 49.682546840563 0.000000000000 1132.843884467593 -18883.024119879890 -17750.180235412299
1.4500e-13 50.117395092442 0.000000000000 1142.759140712276 -18902.941905316977 -17760.182764604702
1.5000e-13 50.786947776435 0.000000000000 1158.026044517046 -18933.570293319983 -17775.544248802937
1.5500e-13 51.657451571600 0.000000000000 1177.874964579916 -18973.365995237076 -17795.491030657162
1.6000e-13 52.693790969831 0.000000000000 1201.505209488391 -19020.724039042074 -17819.218829553683
1.6500e-13 53.860740664264 0.000000000000 1228.113584237426 -19074.034979707631 -17845.921395470206
1.7000e-13 55.124044818248 0.000000000000 1256.918999339337 -19131.734155057813 -17874.815155718476
1.7500e-13 56.451307566455 0.000000000000 1287.182775715643 -19192.342288329801 -17905.159512614158
1.8000e-13 57.812694084840 0.000000000000 1318.224630246533 -19254.497422337990 -17936.272792091459
1.8500e-13 59.181451839188 0.000000000000 1349.434561096222 -19316.978636350079 -17967.544075253856
1.9000e-13 60.534267721256 0.000000000000 1380.280991005091 -19378.722272414110 -17998.441281409021
1.9500e-13 61.851479519092 0.000000000000 1410.315589161191 -19438.831519967276 -18028.515930806087
2.0000e-13 63.117160367879 0.000000000000 1439.175196818513 -19496.580214362293 -18057.405017543781
2.0500e-13 64.319093228780 0.000000000000 1466.581245372786 -19551.411630146489 -18084.830384773704
2.1000e-13 65.448649730056 0.000000000000 1492.336993739269 -19602.932923795233 -18110.595930055963
2.1500e-13 66.500584588746 0.000000000000 1516.322840828575 -19650.905736346343 -18134.582895517768
2.2000e-13 67.472754109371 0.000000000000 1538.489906853600 -19695.233339332757 -18156.743432479157
2.2500e-13 68.365765787239 0.000000000000 1558.852043707764 -19735.944638051864 -18177.092594344100
2.3000e-13 69.182566628108 0.000000000000 1577.476447975430 -19773.175370815090 -18195.698922839660
2.3500e-13 69.927980965569 0.000000000000 1594.473122407151 -19807.146987447421 -18212.673865040269
2.4000e-13 70.608214296791 0.000000000000 1609.983562557461 -19838.143954290543 -18228.160391733083
2.4500e-13 71.230347089962 0.000000000000 1624.169214761089 -19866.490578068064 -18242.321363306975
2.5000e-13 71.801849695525 0.000000000000 1637.200415310187 -19892.528777416042 -18255.328362105854
2.5500e-13 72.330153566790 0.000000000000 1649.246613578247 -19916.598426529152 -18267.351812950907
2.6000e-13 72.822312032462 0.000000000000 1660.468637075040 -19939.021811565053 -18278.553174490014
2.6500e-13 73.284774263109 0.000000000000 1671.013537509926 -19960.093299816941 -18289.079762307014
2.7000e-13 73.723279888511 0.000000000000 1681.012187893841 -19980.074570635283 -18299.062382741442
2.7500e-13 74.142862889948 0.000000000000 1690.579371289844 -19999.194880378862 -18308.615509089017
2.8000e-13 74.547937343440 0.000000000000 1699.815735900242 -20017.655086920513 -18317.839351020270
2.8500e-13 74.942428850070 0.000000000000 1708.810791894348 -20035.633755351471 -18326.822963457125
2.9000e-13 75.329915690697 0.000000000000 1717.646129968400 -20053.293681694198 -18335.647551725800
2.9500e-13 75.713751254186 0.000000000000 1726.398212910802 -20070.787526274078 -18344.389313363277
3.0000e-13 76.097150480774 0.000000000000 1735.140346653345 -20088.261770810641 -18353.121424157296
3.0500e-13 76.483234204483 0.000000000000 1743.943691351042 -20105.858729244195 -18361.915037893152
3.1000e-13 76.875033927270 0.000000000000 1752.877370240729 -20123.716738514144 -18370.839368273417
3.1500e-13 77.275464922698 0.000000000000 1762.007856360478 -20141.968898535313 -18379.961042174837
3.2000e-13 77.687278065965 0.000000000000 1771.397874194922 -20160.740841278079 -18389.342967083157
3.2500e-13 78.113001325101 0.000000000000 1781.105065578145 -20180.148030776116 -18399.042965197972
3.3000e-13 78.554881249561 0.000000000000 1791.180655537325 -20200.293067023857 -18409.112411486531
3.3500e-13 79.014833544294 0.000000000000 1801.668325300074 -20221.263409567062 -18419.595084266988
3.4000e-13 79.494410070760 0.000000000000 1812.603459863198 -20243.129857027652 -18430.526397164453
3.4500e-13 79.994787322038 0.000000000000 1824.012885206400 -20265.946014796100 -18441.933129589699
3.5000e-13 80.516778488607 0.000000000000 1835.915143411711 -20289.748849423264 -18453.833706011552
3.5500e-13 81.060867665302 0.000000000000 1848.321272638574 -20314.560265182699 -18466.238992544124
3.6000e-13 81.627260723254 0.000000000000 1861.235967087807 -20340.389453556851 -18479.153486469044
3.6500e-13 82.215943291394 0.000000000000 1874.658899075390 -20367.235578193602 -18492.576679118214
3.7000e-13 82.826732860944 0.000000000000 1888.585907100593 -20395.090198266520 -18506.504291165926
3.7500e-13 83.459310274397 0.000000000000 1903.009713846689 -20423.938749121065 -18520.929035274377
3.8000e-13 84.113217059921 0.000000000000 1917.919865400919 -20453.760449780166 -18535.840584379246
3.8500e-13 84.787810345616 0.000000000000 1933.301703225284 -20484.526246125533 -18551.224542900251
3.9000e-13 85.482176638171 0.000000000000 1949.134398167950 -20516.194838767035 -18567.060440599085
3.9500e-13 86.195017970325 0.000000000000 1965.388354437887 -20548.707413611624 -18583.319059173737
4.0000e-13 86.924535090611 0.000000000000 1982.022546138700 -20581.982218804693 -18599.959672665991
4.0500e-13 87.668337698224 0.000000000000 1998.982470475703 -20615.910386805994 -18616.927916330293
4.1000e-13 88.423407755835 0.000000000000 2016.199311227740 -20650.354218869310 -18634.154907641569
4.1500e-13 89.186128963618 0.000000000000 2033.590610803502 -20685.148542906329 -18651.557932102827
4.2000e-13 89.952378213929 0.000000000000 2051.062355558811 -20720.104945675455 -18669.042590116645
4.2500e-13 90.717660093533 0.000000000000 2068.512042668963 -20755.017989203257 -18686.505946534293
4.3000e-13 91.477258609354 0.000000000000 2085.832139725595 -20789.672203564809 -18703.840063839212
4.3500e-13 92.226382605571 0.000000000000 2102.913400485950 -20823.848761922196 -18720.935361436248
4.4000e-13 92.960290192757 0.000000000000 2119.647702062239 -20857.331162655217 -18737.683460592976
4.4500e-13 93.674388496471 0.000000000000 2135.930319353714 -20889.909756677880 -18753.979437324168
4.5000e-13 94.364314267812 0.000000000000 2151.661763100128 -20921.385385936577 -18769.723622836449
4.5500e-13 95.026006222349 0.000000000000 2166.749429328342 -20951.572642707732 -18784.823213379390
4.6000e-13 95.655780870001 0.000000000000 2181.109328398624 -20980.303298389339 -18799.193969990716
4.6500e-13 96.250420553238 80467840.792713567615 2194.668092420490 -21007.430308610517 -18812.762216190029
4.7000e-13 96.808269454089 0.000000000000 2207.387966017444 -21032.877845856605 -18825.489879839162
4.7500e-13 97.326210460521 0.000000000000 2219.197873901885 -21056.503368018683 -18837.305494116797
4.8000e-13 97.803057915930 0.000000000000 2230.070781150727 -21078.252506416615 -18848.181725265888
4.8500e-13 98.238505166071 0.000000000000 2239.999695542206 -21098.111105833519 -18858.111410291312
4.9000e-13 98.633168249846 0.000000000000 2248.998663777769 -21116.107281217781 -18867.108617440012
4.9500e-13 98.988566034346 94972998.727793812752 2257.102318528319 -21132.310551890921 -18875.208233362602
5.0000e-13 99.307661869278 0.000000000000 2264.378229047194 -21146.856551450583 -18882.478322403389
5.0500e-13 99.592771137611 0.000000000000 2270.879189879014 -21159.851528696854 -18888.972338817839
5.1000e-13 99.847269437732 0.000000000000 2276.682170225925 -21171.450189455321 -18894.768019229396
5.1500e-13 100.074685220125 0.000000000000 2281.867624569521 -21181.814192375597 -18899.946567806077
5.2000e-13 100.278447435248 0.000000000000 2286.513738626993 -21191.100534083307 -18904.586795456315
5.2500e-13 100.461672705272 0.000000000000 2290.691576516283 -21199.451772943339 -18908.760196427054
5.3000e-13 100.627014590560 0.000000000000 2294.461643783485 -21206.989138044177 -18912.527494260692
5.3500e-13 100.776581191341 0.000000000000 2297.872008585410 -21213.808804935386 -18915.936796349975
5.4000e-13 100.911911869151 0.000000000000 2300.957770900096 -21219.980895839133 -18919.023124939038
5.4500e-13 101.033994892184 0.000000000000 2303.741464869825 -21225.550344580799 -18921.808879710974
5.5000e-13 101.143307782426 0.000000000000 2306.233978782234 -21230.538770911709 -18924.304792129475
5.5500e-13 101.239869479028 0.000000000000 2308.435744481167 -21234.946858759158 -18926.511114277990
5.6000e-13 101.323303596074 0.000000000000 2310.338179747921 -21238.757213858600 -18928.419034110681
5.6500e-13 101.392919892567 0.000000000000 2311.925545951069 -21241.938045193016 -18930.012499241948
5.7000e-13 101.447823030728 53725445.422426432371 2313.177427914839 -21244.448106471107 -18931.270678556270
5.7500e-13 101.488142754411 0.000000000000 2314.096784012751 -21246.292813008080 -18932.196028995328
5.8000e-13 101.511919697247 0.000000000000 2314.638937464924 -21247.382263846608 -18932.743326381686
5.8500e-13 101.518575578879 0.000000000000 2314.790702526955 -21247.689574545449 -18932.898872018493
5.9000e-13 101.507976654675 0.000000000000 2314.549029600949 -21247.208247442228 -18932.659217841279
5.9500e-13 101.480560581955 77381903.001053154469 2313.923897994533 -21245.958024663068 -18932.034126668535
6.0000e-13 101.439334088290 0.000000000000 2312.983866047773 -21244.076221061780 -18931.092355014007
6.0500e-13 101.383732604552 0.000000000000 2311.716060654832 -21241.537132832749 -18929.821072177918
6.1000e-13 101.315971969448 0.000000000000 2310.171006587237 -21238.442190651465 -18928.271184064230
6.1500e-13 101.238698040385 0.000000000000 2308.409033750997 -21234.912530993821 -18926.503497242826
6.2000e-13 101.154827517789 0.000000000000 2306.496647719039 -21231.081659363481 -18924.585011644442
6.2500e-13 101.067381091823 68892508.729905933142 2304.502725201497 -21227.087775933844 -18922.585050732345
6.3000e-13 100.982359372982 169562217.574805349112 2302.564089999380 -21223.204904290720 -18920.640814291339
6.3500e-13 100.901715040790 91051991.646203160286 2300.725266421466 -21219.522501630421 -18918.797235208956
6.4000e-13 100.830134370164 137291796.435539186001 2299.093109253179 -21216.254315185222 -18917.161205932043
6.4500e-13 100.769333836480 76790530.791780740023 2297.706756959737 -21213.478762452916 -18915.772005493178
6.5000e-13 100.718706329717 0.000000000000 2296.552366432897 -21211.168192826342 -18914.615826393445
6.5500e-13 100.677880214588 174120187.506460100412 2295.621463776105 -21209.305675425832 -18913.684211649728
6.6000e-13 100.653356339579 55952001.336968310177 2295.062279040333 -21208.187730952512 -18913.125451912179
6.6500e-13 100.640958226726 0.000000000000 2294.779581650248 -21207.623870049683 -18912.844288399436
6.7000e-13 100.639446819821 0.000000000000 2294.745119083863 -21207.557431715009 -18912.812312631148
6.7500e-13 100.648448314501 184333714.889515459538 2294.950367986077 -21207.971234640288 -18913.020866654209
6.8000e-13 100.672529346630 54293960.884311266243 2295.499455174933 -21209.073530802154 -18913.574075627221
6.8500e-13 100.707723185659 0.000000000000 2296.301932661491 -21210.683117523360 -18914.381184861868
6.9000e-13 100.750217435514 138303134.855293035507 2297.270871537114 -21212.625957838518 -18915.355086301402
6.9500e-13 100.801028078367 0.000000000000 2298.429437868404 -21214.948521269631 -18916.519083401228
7.0000e-13 100.855620721515 0.000000000000 2299.674240034540 -21217.443694224476 -18917.769454189936
7.0500e-13 100.912322255911 0.000000000000 2300.967128394048 -21220.035131607368 -18919.068003213320
7.1000e-13 100.969409215777 93534525.905966237187 2302.268805088979 -21222.644218475438 -18920.375413386460
7.1500e-13 101.027596522277 44072793.526799157262 2303.595571499186 -21225.303672369795 -18921.708100870608
7.2000e-13 101.083913384717 136421853.714708119631 2304.879688704620 -21227.877902505759 -18922.998213801140
7.2500e-13 101.138079781396 0.000000000000 2306.114771749347 -21230.354134604702 -18924.239362855355
7.3000e-13 101.185173168893 0.000000000000 2307.188578536978 -21232.507853405208 -18925.319274868230
7.3500e-13 101.223380989136 146989078.742989242077 2308.059779758619 -21234.256387746380 -18926.196607987760
7.4000e-13 101.253330191092 0.000000000000 2308.742670883124 -21235.628428887496 -18926.885758004373
7.4500e-13 101.270582567130 0.000000000000 2309.136053467775 -21236.421442169143 -18927.285388701370
7.5000e-13 101.273396455537 52543282.456574238837 2309.200214757313 -21236.555933866191 -18927.355719108877
7.5500e-13 101.260786312900 50478875.563574224710 2308.912682738988 -21235.986832504477 -18927.074149765489
7.6000e-13 101.233044644123 114192522.871039137244 2308.280127006291 -21234.727285012257 -18926.447158005965
7.6500e-13 101.189872317893 184462270.039994597435 2307.295726872682 -21232.763457389723 -18925.467730517041
7.7000e-13 101.132587047742 57767040.799043327570 2305.989528376672 -21230.155248726234 -18924.165720349563
7.7500e-13 101.055898509856 172816247.226023375988 2304.240903423288 -21226.661093184430 -18922.420189761142
7.8000e-13 100.959467989391 199581971.051283359528 2302.042128756306 -21222.265466619927 -18920.223337863623
7.8500e-13 100.844822900482 0.000000000000 2299.428031933284 -21217.037854076494 -18917.609822143211
7.9000e-13 100.708132571311 0.000000000000 2296.311267328540 -21210.803457085462 -18914.492189756922
7.9500e-13 100.550485537268 82852587.335772812366 2292.716655341487 -21203.611955147448 -18910.895299805961
8.0000e-13 100.376412827676 64663370.565699055791 2288.747510902349 -21195.670061386096 -18906.922550483745
8.0500e-13 100.186766131912 62818096.025483191013 2284.423253931498 -21187.016783311825 -18902.593529380327
8.1000e-13 99.984661803613 40673745.137080729008 2279.814942423773 -21177.794440303867 -18897.979497880093
8.1500e-13 99.771608746194 145899561.290219575167 2274.956981861916 -21168.072042021275 -18893.115060159358
8.2000e-13 99.536365488773 52575189.963680639863 2269.593048197501 -21157.335923320807 -18887.742875123306
8.2500e-13 99.296347675291 26785077.410323273391 2264.120246792246 -21146.381777252493 -18882.261530460248
8.3000e-13 99.053958371976 44394650.135883234441 2258.593371513434 -21135.319572248864 -18876.726200735429
8.3500e-13 98.814387873513 48920596.857503734529 2253.130769627242 -21124.386318174860 -18871.255548547619
8.4000e-13 98.580425959226 99841331.509202435613 2247.796052696381 -21113.709426047943 -18865.913373351563
8.4500e-13 98.359247104798 47265490.834025457501 2242.752810581265 -21103.616095545032 -18860.863284963765
8.5000e-13 98.150778120109 0.000000000000 2237.999374426635 -21094.102841062511 -18856.103466635876
8.5500e-13 97.956110742762 0.000000000000 2233.560637647702 -21085.219160015433 -18851.658522367732
8.6000e-13 97.778084686544 0.000000000000 2229.501350395173 -21077.094264683878 -18847.592914288703
8.6500e-13 97.619512630961 0.000000000000 2225.885646393700 -21069.856257653217 -18843.970611259516
8.7000e-13 97.483219554591 0.000000000000 2222.777939807007 -21063.634066041552 -18840.856126234543
8.7500e-13 97.371998065401 26645073.594592466950 2220.241906695509 -21058.555489844177 -18838.313583148669
8.8000e-13 97.289063475627 0.000000000000 2218.350861473179 -21054.767939120688 -18836.417077647508
8.8500e-13 97.235933357948 0.000000000000 2217.139407296187 -21052.341552058635 -18835.202144762450
8.9000e-13 97.214039677538 50761698.241923235357 2216.640195328640 -21051.342483408411 -18834.702288079770
8.9500e-13 97.223115878023 0.000000000000 2216.847147646246 -21051.759012974468 -18834.911865328220
9.0000e-13 97.263060663199 0.000000000000 2217.757954528769 -21053.586579173647 -18835.828624644877
9.0500e-13 97.332007238955 31399035.525223266333 2219.330049996222 -21056.739562301977 -18837.409512305756
9.1000e-13 97.427574349810 134108345.848325118423 2221.509137502269 -21061.108561615609 -18839.599424113338
9.1500e-13 97.543947992142 46993105.597974032164 2224.162648189874 -21066.427494870091 -18842.264846680217
9.2000e-13 97.680103711247 0.000000000000 2227.267222804751 -21072.649039091510 -18845.381816286757
9.2500e-13 97.830104234863 0.000000000000 2230.687481761890 -21079.501925473214 -18848.814443711322
9.3000e-13 97.989644951229 42377817.226953580976 2234.325272824403 -21086.789585495320 -18852.464312670916
9.3500e-13 98.156013360592 46175612.273578554392 2238.118746530957 -21094.388188629342 -18856.269442098386
9.4000e-13 98.324581727232 56844353.038442038000 2241.962382886326 -21102.086544355490 -18860.124161469164
9.4500e-13 98.492884883650 131755971.208584144711 2245.799972011856 -21109.772051808748 -18863.972079796891
9.5000e-13 98.651587182847 61568287.064322657883 2249.418645782222 -21117.018743873890 -18867.600098091669
9.5500e-13 98.801142011416 41643130.795075833797 2252.828742158333 -21123.846914048638 -18871.018171890304
9.6000e-13 98.938967520086 73259641.783949464560 2255.971390725063 -21130.138592788724 -18874.167202063662
9.6500e-13 99.054039784001 0.000000000000 2258.595227841666 -21135.390897197922 -18876.795669356256
9.7000e-13 99.152235518797 59873855.602764263749 2260.834252302343 -21139.871903600666 -18879.037651298324
9.7500e-13 99.228184578056 65545500.698350220919 2262.566015925287 -21143.336738614140 -18880.770722688852
9.8000e-13 99.287298173864 133043291.212442994118 2263.913903257108 -21146.032356644424 -18882.118453387317
9.8500e-13 99.332676848904 67949306.321875095367 2264.948611776983 -21148.100272304408 -18883.151660527423
9.9000e-13 99.358256017024 0.000000000000 2265.531858933524 -21149.264149768715 -18883.732290835193
9.9500e-13 99.365437590893 118461652.350641116500 2265.695610644236 -21149.587715831352 -18883.892105187115
1.0000e-12 99.359604739027 0.000000000000 2265.562612016246 -21149.316492672522 -18883.753880656277
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