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学习率对神经网络的影响-乙烷,乙烯,乙炔的分子模型试验数据对比

發(fā)布時間:2025/4/5 编程问答 32 豆豆
生活随笔 收集整理的這篇文章主要介紹了 学习率对神经网络的影响-乙烷,乙烯,乙炔的分子模型试验数据对比 小編覺得挺不錯的,現(xiàn)在分享給大家,幫大家做個參考.

在《用神經(jīng)網(wǎng)絡(luò)做分子模型:乙烯和乙炔的實驗數(shù)據(jù)》中計算出了乙烯和乙炔分子模型的鍵值,得到C=C的鍵值平均0.5051 ,C三C鍵的鍵值平均0.5019




本文計算了乙烷的實驗數(shù)據(jù)





當(dāng)學(xué)習(xí)率是0.1時


R=0.1C-HC-HC-HC-C迭代次數(shù)
0-500.49970840.4999394340.499133740.508797898558672.4
50-1000.49944870.4997489980.499192580.508174723607833.5
100-1500.49999440.4998140370.499504980.508959569562910.46
150-2000.49952030.4991402710.499326760.507144683760472.72
200-2500.49931660.49927150.499469450.508440791544282.94
250-3000.50007510.4993009790.499431060.507403571709156.72
平均值0.49967730.499535870.49934310.508153539623888.123

得出C-C單鍵的值0.5081

C-C????????????? C=C????????????? C三C??

347????? <??????620?????? <????? 812??????鍵能實驗值

0.5081?? >????0.5044??? >??? 0.5019???模型計算值

模型計算值還是很好的體現(xiàn)了單鍵,雙鍵,三鍵之間的梯度。

同時為了試驗學(xué)習(xí)率對C-C的特征0.5081是否有影響,測試了當(dāng)R=0.01時的數(shù)據(jù)


R=0.01C-HC-HC-HC-C迭代次數(shù)
0-500.49974940.4998118220.499180240.5082372015592483.74
50-1000.4998430.4993512290.499192020.5085816285891083
100-1500.49955540.4992484870.49918750.5082010765670468.74
150-2000.49924710.4994649740.499149410.5071872257363639.96
200-2500.49945350.4993233940.49935850.5079483456476986.08
250-3000.49968490.4991430810.499502450.5068348728402162.84
平均值0.49958890.4993904980.499261690.5078317246566137.39


得到C-C的特征值是0.5078與0.5081相差約0.06%,而迭代次數(shù)6566137.39

是623888.123的10.52倍

A???? 0.507831724??? ??6566137.39

B???? 0.508153539????? 623888.123

?

?

A/B?? 0.999366698?????? 10.524543

?

?

又測試了一組當(dāng)R=0.001的數(shù)據(jù)

R=0.001

C-H

C-H

C-H

C-C

迭代次數(shù)

0-50

0.4997787

0.49913978

0.49942204

0.507745555

65161912

?

0.507745555/0.508153539=0.999197124

65161912/623888.123=104.44

可以看到迭代次數(shù)就是擴大了大約0.1/0.001倍,特征輸出變化不大。

在《由神經(jīng)網(wǎng)絡(luò)的迭代次數(shù)計算輸出值》中得出了一個迭代次數(shù)與輸出之間的一個關(guān)系式

Y=k*(-ln(x))+b

Y是輸出比如0.5081

X就是迭代次數(shù)

如果把學(xué)習(xí)率加到這個方程里面


Y=(-k*ln(x*r2/r1))+b

K,b都是常數(shù)可以由已知數(shù)值代出來,r1=0.1 ,r2是學(xué)習(xí)率

所以對于特定結(jié)構(gòu)特定輸入的網(wǎng)絡(luò)學(xué)習(xí)率改變也許并不改變網(wǎng)路的特征輸出至少變化范圍不大。

?

C2H6 學(xué)習(xí)率 r=0.1

0-50數(shù)據(jù)

C-HC-HC-HC-C迭代次數(shù)
0.49950240.4967399150.49957910.506415823697861
0.49972280.4995422550.499630720.506523328417795
0.49983240.5097065720.499873960.5066167611248719
0.49913360.5044676880.497335110.511041973287863
0.49709580.4981031540.499203590.507060641362686
0.49989380.499762110.496331610.5036063571120073
0.50658740.4989222750.499813170.5033734721755100
0.49980120.4986343420.499004720.511362311266651
0.49989290.499754740.496268890.5036808871098230
0.49967790.4996587180.504457470.507426442441240
0.49983770.4997973860.499846870.5043717961298498
0.49938750.4995562180.499682690.5057078181090252
0.49958530.5051763510.497657850.511580107254183
0.49934210.4985379990.499543820.510747062253976
0.49911860.4998869450.499851020.506521878822121
0.49968470.4991589750.496619290.50594528672132
0.49908390.4972808460.499780690.507351275403684
0.49970230.496777340.499407430.506130639603213
0.49944940.4981452290.49928620.516076401142459
0.49977190.4996533060.499540380.507690676466671
0.49986530.5029387370.499852710.506826206702740
0.49651330.4999352010.499201350.5045488511282796
0.49980110.5021322830.499829540.5046361431241757
0.49909720.4995758340.497256390.510155912230340
0.49778360.4973568180.499754590.505266729636061
0.50332140.4991057830.499596090.513688232255158
0.49940350.4993621940.497697020.512286675273529
0.50320150.4998059030.49715660.508018122475373
0.49780920.5013274170.497831280.509390272278521
0.49970130.4997775240.499792380.506154392579004
0.50167110.4992578850.497747410.514717918208023
0.49924020.4977812210.497256320.508857067284266
0.49942350.4985755310.497560360.513173374185072
0.49719840.4991897420.497568260.509929799311138
0.49989780.4997356210.499752020.504074011007006
0.49985120.498399040.499862570.5054383111174687
0.49984610.4975122310.496340740.5042598881255263
0.49683090.499844410.499668830.507908725566078
0.50593260.4996088880.499300430.513792558192055
0.49784840.4995148680.499303690.51084909242075
0.49704950.4995667870.49975730.506906598387457
0.497810.499397780.504582040.51296099197969
0.49789510.499424140.497804320.514392539178525
0.49934460.498392280.498333050.511539299236761
0.49942580.4997620470.499430520.507829327426900
0.49767170.499146540.503418030.508285976520178
0.51014540.510604930.499727260.513484084312993
0.49811520.497594020.498883960.514846432142989
0.4991650.5048711340.501225190.510128486325600
0.49845880.4982125550.498482340.516317946119899
平均值
0.49970840.4999394340.499133740.508797898558672.4

50-100數(shù)據(jù)

C-HC-HC-HC-C迭代次數(shù)
0.499550.4998794770.49952710.5085272371608
0.49985660.4998686260.49672710.5044325919589
0.50242440.504082560.49925170.5094463276664
0.49844980.4972812810.49965650.5086159371206
0.49934650.4988612620.49908480.514898157271
0.49724620.4997429360.49673320.5076543479741
0.49794260.4990473760.49940210.5073323361899
0.49647350.4996797950.49991440.50510581331158
0.49882850.4996940540.49951920.5077517305246
0.49950730.4992585110.49950740.5133251216773
0.49992810.4997510170.49955660.50653121490334
0.4998070.5049467410.49686720.5074182418172
0.49961440.4994264950.50152240.5138578208614
0.49979340.4997188310.49987840.5053903786384
0.49984960.4965784250.49940790.50485561025343
0.49907730.4998383720.49852340.5075352436471
0.49760630.4997472390.49851740.5101814338845
0.49953030.4998906370.4965970.505363882882
0.49981060.4998543890.49989270.50559911065734
0.49733210.4989055680.49946820.5111615238164
0.49795740.4996075750.49952380.506153591869
0.49978490.4996733030.4971060.507394538247
0.49975720.4970895460.49954590.5082582431887
0.49992170.5016821490.49928560.5103917209114
0.50654750.4996868970.49997590.50345482695653
0.49872310.4990681790.49883820.5165692118367
0.49982620.4998182010.49938840.5075146570365
0.49951260.4989988140.49853210.5071971452394
0.4992110.4975073750.49859430.5115224220845
0.49966290.4997837070.49932270.504941781456
0.49937020.4982589010.49976450.5131057203014
0.49984050.4992783730.49975050.5048959692392
0.49974050.5061729250.49963610.50744771134576
0.50397580.4996533150.50624570.5097517379924
0.49986110.4996781210.49984380.5078906572176
0.49856010.4995236060.49691650.5083985418975
0.49825730.4995089970.50319660.5109799277588
0.49971640.4964414050.49620140.5044076967341
0.5008970.4983352990.49623430.5047791990629
0.49897930.502400790.50599750.510448246706
0.4997380.4995843620.49765730.5115567410296
0.49687170.5008133940.49884440.5045816914841
0.49770180.4995508380.49977670.5084212436949
0.49960080.4969654080.49960470.5064809585979
0.49955490.4979587250.50143880.512345268975
0.50028820.4995444030.49939470.5098909275617
0.49981950.4994938390.49680170.5056429574995
0.4989280.5077659510.49953640.50603771298459
0.49627410.4981637570.49644310.5058984608772
0.50157940.4993881550.49667660.5073979841176
平均值
0.49944870.4997489980.49919260.5081747607833.5

100-150數(shù)據(jù)

C-HC-HC-HC-C迭代次數(shù)
0.501605380.498486940.4997398890.5050049702027
0.497619450.499712520.4996632530.5107483376856
0.499900650.499034650.4983724090.5181273123014
0.496535540.499797480.4971187560.5066111710552
0.502478960.499800840.4998720340.50332171229228
0.499529680.49947240.4981243280.5076947399317
0.499889030.499905730.4996914140.5074931910373
0.497096510.499714530.4990421690.5108693300998
0.501161990.499859520.4994552950.5081059554265
0.49959040.498547090.5038012920.5101966265544
0.499486290.496620440.4996857350.5058013602688
0.499245510.499364820.5002857790.5115647276631
0.498716370.499299980.4974438910.5112984219743
0.499343420.498769810.4994662580.5114553231444
0.498177020.510712660.4995779550.510363271246
0.499821610.499817640.4995816360.5085386473449
0.499828490.499896280.4996507070.5055256741775
0.508782480.508262010.499842530.50645811351955
0.505046120.497373140.4975351390.5094661239746
0.497161630.497882630.4995422610.5075728418506
0.499923970.502222680.4994789470.50401691242255
0.499250450.498128470.4997802810.5060272821765
0.498379920.499467790.4989454390.5140237210505
0.499863070.49654680.4988815270.5066156660493
0.499188490.499147120.4992966760.5110813251562
0.497275230.498944610.5013116230.5106217297859
0.512431020.499670110.4980150470.514038170183
0.499304250.502359090.4982044050.5113655231338
0.497386140.498947160.4976523080.5085204316902
0.496423470.499113510.498992420.5060092620072
0.49962090.499550370.5048114120.5110102289645
0.49849440.498776390.5027691710.5172913152777
0.49859730.49617850.4998509660.50370811260241
0.49798440.497053770.4995486030.5072167457310
0.499954150.496707320.49990950.50495111059431
0.499465720.498245810.5010613870.5144272171553
0.49945840.499621460.4993770840.5085823409732
0.49991090.50237820.4968221690.50554421066005
0.504185540.501332410.4998016550.5096286449910
0.497660070.498837160.4982979130.5131799206026
0.49926720.49955930.4990794630.5113069286883
0.499428590.49702480.4999061230.5067474909741
0.499785090.499869930.4998766730.5071707616303
0.503695090.500108660.496685350.50445591383569
0.499086860.499630040.5034961810.5104524376891
0.49818930.510005180.4997791870.5097186403177
0.499866840.498830230.4972031590.5058104696365
0.505886960.499900630.49993030.5061121394161
0.502550870.500353890.499508820.5170673194564
0.496190560.499859330.4994825620.50506061138948
平均值
0.499994430.499814040.4995049820.5089596562910.46

150-200數(shù)據(jù)


C-HC-HC-HC-C迭代次數(shù)
0.499859870.496317190.499630540.504853271303853
0.499856710.496019480.49817360.503005382184026
0.497549620.496211480.497673960.50480594865340
0.499295680.498469190.497235370.50853261439678
0.49993730.498752540.50759810.504832841801277
0.498431130.499232340.497026810.50563234627114
0.496951740.499692090.501906940.50641861558551
0.502372690.496651750.499914740.50503766983329
0.499671220.499796970.496922820.50622873430
0.499778160.49921620.499295020.50673581413367
0.499778190.498953990.499219980.5068066636317
0.499851450.499365230.499906330.50445701987014
0.499964010.499917330.499922170.503175282104209
0.499650750.498637550.499603570.50948322304919
0.499553330.49979730.499870340.50686008600795
0.499776610.497658940.498231260.504333991031951
0.499945090.499906920.499740570.50339991439059
0.498668580.499248770.501491610.509373389038
0.499057910.499474450.499405490.50962247230829
0.501050840.499605940.499456990.51000966285846
0.503645660.499500420.497107620.50832367381765
0.499164440.49974790.499433960.50912638387246
0.499531650.49884090.5053580.51100386239539
0.497578030.497037120.499415520.50948446380851
0.499528370.499802660.499801610.50954338409035
0.499750370.499794530.499022290.50526302926919
0.499395160.499838760.49961540.5042866908999
0.499636480.499748160.497028670.50984335316244
0.499669140.499261540.497722830.51101083344990
0.499924640.499952390.499900340.504189072196588
0.50207020.498805140.501162180.51193681222293
0.499298170.499251060.500675710.506423587847
0.497329790.499909090.499706360.505538061359961
0.499819540.500784860.499865780.5091894659769
0.499725270.499284520.499673680.50781282459851
0.499659370.499391110.499644920.51173232275003
0.499719540.497478380.499382970.5100001260505
0.49953880.499305430.499573660.51264607185287
0.499827650.49956410.499780080.50943581427424
0.499761220.501889160.496248210.503303472446702
0.496347960.499929720.499933430.506076431184602
0.499757160.496829610.497983030.50499732541972
0.497320520.498449050.496997740.50617966529998
0.499037210.499298050.499701630.50842555317182
0.500719620.499731910.499182350.50666865462024
0.499752550.498649460.496042220.504400751240156
0.499848590.503655770.498572210.50714002644187
0.499705960.499765260.499415640.50593876628760
0.499805480.499666320.499663230.5076529436206
0.498146720.498925450.496500510.50606598601789
?????
平均值????
0.499520320.499140270.499326760.50714468760472.72

200-250數(shù)據(jù)

C-HC-HC-HC-C迭代次數(shù)
0.499770260.498037950.504561390.50865873406522
0.496565360.499726830.499839890.504743271344853
0.499723850.496836670.498931170.50636805650346
0.498825390.498974570.498935980.51269343177161
0.497673850.496875650.498535780.50785021371485
0.49989020.496562310.497655660.503714891451384
0.500710370.497311110.499481390.51400864186745
0.499621120.499517990.499336470.51033567314394
0.499629810.503161340.498237740.5075166422708
0.498472950.499356990.500259980.50572056546682
0.499229260.499040220.497733880.51346536215787
0.498750940.499906250.499853590.50549244930890
0.504202750.497844460.499554860.51059494208363
0.498348020.499778270.499781170.5084393401746
0.496357940.49972540.499744650.50459253942710
0.499629040.499237760.499727490.50851427369485
0.499100140.499627850.498624530.50896336358903
0.498994420.514690440.499243730.51504164141117
0.497009460.499865050.499842050.50638316757893
0.497396870.499718220.49961860.50867053354392
0.50159230.496846480.498936690.50542106632705
0.496784250.498157350.499899930.505237831291098
0.499630130.49623790.499908770.504134451293419
0.499094370.497606080.499301960.51601268126940
0.497821480.499584640.499480610.51289586226222
0.496501240.499418480.499860040.50606838990132
0.498394440.496676160.49984480.50505308890764
0.496985860.499176670.497704180.50800303326476
0.497295420.499736790.499886310.503917551225745
0.499624350.498789270.499592960.50748946471876
0.497696640.497446860.500296740.50935667296430
0.497703660.50383330.498792670.51104983189224
0.499573280.499876360.497601640.50471293928891
0.499713980.498143430.496680810.50650183644507
0.49743510.499497690.498877380.50723886369457
0.499344160.499582560.499701830.51227451267872
0.507261850.504396760.499866290.50644606714191
0.499785360.499914730.499771850.505475851098618
0.49949140.49965330.499431710.51447109212612
0.499405490.497871450.499224990.51107068217044
0.499728120.496936390.499853880.50653956611003
0.499180890.499667290.498994890.51194869234024
0.499783790.499664890.499453770.50777864359056
0.508503750.500097240.507515690.50669466959792
0.497686460.496877850.49893290.50766122356586
0.499767570.498822390.499601160.50910669330029
0.499410080.499211190.497651460.51160279145995
0.49900650.499035860.49986110.50967852526474
0.499829250.497521850.499294420.5085522415293
0.501894670.497498440.498151230.5078773308106
?????
平均值????
0.499316560.49927150.499469450.50844079544282.94

250-300數(shù)據(jù)

C-HC-HC-HC-C迭代次數(shù)
0.502039060.497379760.496670650.50488294711111
0.498177720.500173770.498645960.5104605215368
0.499670190.50150680.512831420.51136616331944
0.50403120.499591510.497820650.50837591222887
0.499699960.498293770.499710350.50900041308378
0.499210130.499534060.496998510.51179394226363
0.498928840.499952620.499950840.504864071780313
0.49691770.498442760.499896780.50596558708823
0.497772460.499772990.49929260.5054077800248
0.501240410.501630430.499642720.50891944494224
0.499922320.499411520.499876130.503896061770060
0.496875920.499821460.50329560.50869727549769
0.499940970.499889470.499939890.504121451345249
0.509291060.499469540.497596070.50784671315135
0.497746580.4998750.498119490.50708428557945
0.501904850.499869290.499839410.50495291022947
0.501720440.498658430.496965340.50819268427614
0.49990510.499869440.498415850.50405041289577
0.498577170.496080630.497897410.5046857926751
0.503845110.499580060.499354960.51184627288176
0.499568430.498809070.499440560.51146102332871
0.499823720.496693550.4991360.50604821574551
0.499666110.499511940.500521430.50870374437875
0.499778120.496945650.49979590.50830298415755
0.49935630.499355240.497899720.51241835188654
0.499850810.496906360.499759930.506076681262
0.498439440.499865480.499949650.504048451570501
0.499905660.496317350.49884270.503509371141114
0.499860220.499349360.496629830.50521952661493
0.499670780.499542890.504521050.51153006232236
0.499918550.499893870.496636470.504578591094265
0.498981580.499570070.497004280.50918184320605
0.500538880.499692480.49723740.5080366382388
0.499767760.500731650.503642820.51092642377339
0.499802970.505589840.49970740.50930345446534
0.499834070.49992010.496631580.504739181153383
0.499677040.501494260.500080350.503561541721005
0.49990420.496367460.49650510.50486171036513
0.499372650.497333130.499740780.51193412291534
0.501635280.499495640.4992060.51770889181001
0.502486290.499832050.497086480.50802681477401
0.499861030.499483570.505566320.5072445496534
0.499040560.498160520.499710820.50835106354321
0.500093590.499734990.496110950.503805411431438
0.499750040.499768050.496973540.50879662332808
0.498840470.499880310.496831040.50467535910402
0.504528780.499829870.507210650.504747331161168
0.498908020.499534130.49990850.503513741640528
0.496667050.496869530.499753070.50682462482992
0.500809550.499767240.496752250.5056327636483
?????
平均值????
0.50007510.499300980.499431060.50740357709156.72



C2H6 R=0.01 實驗數(shù)據(jù)

0-50數(shù)據(jù)


C-HC-HC-HC-C迭代次數(shù)
0.505077990.497285480.498381990.511213152549798
0.499267240.499292290.498853310.514621431597862
0.499840250.498460750.49899680.507988535529332
0.498016650.499588560.499725990.509237453518362
0.498425140.500163320.496634280.506659215562791
0.499164960.499700240.496305430.505272457867935
0.499296230.507032860.499035390.51129822635653
0.499924070.507364950.498963680.5057709517288067
0.499836080.499125790.499616170.506293034613040
0.499787540.498300770.497849390.508752084680668
0.498957080.497087470.499401370.512868541582860
0.499841480.499717110.499831230.50761435501929
0.498451030.503518320.497126360.505236049138406
0.497508260.503606460.499702860.507753473266243
0.499108140.499096260.498610720.513384461262597
0.499803870.497052040.499771170.506001454809566
0.497388170.496881330.499772910.5042369110110446
0.498038240.499147090.50464410.512566941919912
0.498466960.49937590.499598440.513336362208323
0.499263050.499802280.50399730.508858513877745
0.499407950.499766230.497841270.505720516492320
0.505522590.499532970.499386740.509306761965692
0.496829910.49974230.499788940.507329614724281
0.505098380.499855370.497588920.505325688820171
0.499876040.499885460.499557270.507575386464076
0.502653510.499781660.499518140.507566024334463
0.499818240.499472410.499850910.5057366711684572
0.499805610.499864270.499148620.504870769274994
0.499790630.496776720.499701380.506293916036132
0.498678650.498069070.498906270.511349772949449
0.501982430.499453110.497928820.513771541769481
0.501948960.50353170.501445080.512118443325933
0.49982870.49951120.499812120.506962794632654
0.499647030.499692320.499654210.508805784047495
0.499914330.49907480.499914250.504443610980529
0.499889780.499545350.499496980.505329126592399
0.499696030.499633150.498453650.50694345631680
0.498306990.499749210.499615450.510816483323974
0.499822210.499818140.497960990.506383855225522
0.499853940.499940160.498898190.5033195813881006
0.499744360.498994460.496724820.507098495173836
0.499856230.499857710.496358220.505575497345588
0.498798160.499823780.499828560.5030037213100001
0.498887650.505786880.4997640.51315883367458
0.49701250.496778330.498647810.505628795327363
0.499181110.498887710.499717520.511886422633487
0.499340620.499392290.499439110.510503072686333
0.50331770.49771710.498776970.510260942424229
0.496618110.499899370.49980910.5052792913471551
0.500880640.499158640.498658520.510531942415983
?????
平均值????
0.499749430.499811820.499180240.50823725592483.74

50-100數(shù)據(jù)

C-HC-HC-HC-C迭代次數(shù)
0.497123790.502541860.499596640.510538633475811
0.498415990.49862590.499330760.515853771343518
0.499660660.499345630.498173960.508679323556846
0.499320050.499015360.49680560.506815753649315
0.49834630.497502240.498605790.514792291799025
0.496849690.501751920.499596150.506302126028299
0.499502510.499743850.497407110.50863483945028
0.497552270.499832230.499377130.5078273510996371
0.499866480.499861160.49950080.5050591612775443
0.50564350.498240.498674660.513514891579332
0.499319340.499728640.499026630.508380544136967
0.499463790.498624160.498012040.511195941954785
0.497073610.497801240.49789210.51075252768389
0.499921360.498269660.499230090.503910917112653
0.498959060.49731810.497908060.511216222757933
0.499512970.49964360.499021270.504934548536861
0.502541510.497317080.503644870.509349283461958
0.498510040.499913650.499924290.5037046415992972
0.499206180.499323890.499837650.505228946451513
0.49985050.499851670.49992010.5051276110662092
0.500208710.49875840.499910460.50551868201670
0.499689880.497776080.499683090.507921023658495
0.499905380.497939360.4962580.5045253212279219
0.499759380.498930850.499680370.505283928120111
0.499359560.49776560.499456650.513825691733938
0.500905920.497462780.498569970.509712623101548
0.499926370.499956520.499244860.5032015816644784
0.499528280.49986740.499657780.506170346011880
0.505056860.501506980.499118060.512550593160901
0.498253180.499327590.498323980.508973163038144
0.498874320.499645170.499733970.507537283707205
0.499519830.499664920.497471450.509045743121089
0.497939210.499360750.49835390.513609161533037
0.49975580.497564190.496022330.5041489116002059
0.507196490.502532910.499798020.511395494351368
0.499441270.508124530.499415890.514645451629210
0.497540820.499398450.499407210.5088154811241
0.49964080.499552760.499754580.509581094281129
0.499702050.497874250.500861640.50802734255817
0.499134150.497613050.499235710.511057862282462
0.499699580.496995780.499776870.507478756668512
0.499931760.499834660.498194960.5047013917219125
0.506466580.499531720.501293110.514395912103861
0.502414570.497676170.498821780.508780452550410
0.499856560.499856070.503279540.506414067622720
0.499278030.499705430.499509310.508230613879937
0.499592450.498743750.499704230.509379192881542
0.500268870.499849250.497922060.505355166700503
0.497374680.502250190.499865460.507618596028562
0.499289890.498244040.499790230.509361993988560
?????
平均值????
0.499843020.499351230.499192020.508581635891083

100-150數(shù)據(jù)

C-HC-HC-HC-C迭代次數(shù)
0.497244510.498393250.496742610.507061063209263
0.499849060.496638150.49983450.5041578111448773
0.499546240.499715480.49741040.509453313043135
0.499302370.497552280.499071210.511850281718057
0.496311320.499954950.499936230.5030713122748647
0.498719680.504041710.499247690.512164121802896
0.499328660.498263210.499253840.513940921548719
0.499812450.499035770.498498470.505695075704414
0.499822730.497309310.497563950.507833044264586
0.499840580.499869930.499742520.5066486533650
0.498722930.496875940.498435970.506712295361816
0.499878260.499810120.496890420.504317218657929
0.498895210.499476050.498331440.51770522937206
0.499636830.497147490.498365480.510676313287422
0.498521320.499543420.499376060.511628192223721
0.499358630.499271010.497954580.508664683438311
0.497552110.499861110.499605930.504761357839276
0.497890760.49862440.503221430.507239045280331
0.497602090.499228360.499229010.509797752095274
0.498088690.498323520.497120260.514026382362684
0.500977310.497430870.49979410.507815024180148
0.499289080.499210260.501582280.512673562198037
0.498733260.499239560.49943890.510027642192043
0.501632480.501771720.497087960.506548046186250
0.499833280.4970040.499279680.508657774766763
0.499932660.496318890.499924560.5039630912529009
0.507830740.499571210.497432590.508819333462522
0.499503020.498666510.499696380.511638272525832
0.502082730.499537720.497348170.507147182945718
0.499887380.499757860.496851230.50487498563423
0.498886040.499854160.499737980.50632754775693
0.503549540.499725110.499406170.50635576700987
0.499803590.499777010.497256250.506493256185067
0.498673180.499662020.498576040.507418794302315
0.498323730.499882380.499752130.505687917099930
0.497802880.498821880.499736310.509355713488857
0.499835020.49698670.499863680.506742135754904
0.4997090.504452590.499654560.511663942683072
0.506350710.499960620.500430470.5034822522162009
0.500738610.499892620.499867910.506152849774007
0.498825310.499527450.4975920.513882651851590
0.498108530.496878290.496746070.506018856021178
0.499661520.499052160.500528920.512722782909773
0.498969580.499861590.496327060.505733586833387
0.499455190.50063050.497534380.5041154413606679
0.499787940.497621580.505466250.511204643529913
0.497738510.506652490.509321750.509008014070877
0.499404270.499894630.499804910.506914745123652
0.496761830.49933290.497625890.505560775871587
0.499759990.496513610.499878330.505644197722105
?????
平均值????
0.499555430.499248490.49918750.508201085670468.74

150-200數(shù)據(jù)


C-HC-HC-HC-C迭代次數(shù)
0.499871290.499405730.498534720.505427396006624
0.497863420.499681250.499891180.5042772511196774
0.499524970.499770330.499478740.508245483542122
0.499192840.497621930.49834990.513921871750833
0.506562880.499601860.499875910.5038393713572273
0.498706620.49939390.499689360.507280393774655
0.50780350.503523710.499633020.511485372319570
0.499884510.508103530.499333250.5057443511342777
0.496904050.498636770.499540640.506663414036942
0.499610040.496785820.498689550.507894263134272
0.49939240.496825030.499865380.505945875793416
0.499678330.499875120.499816970.5046492510009664
0.499897160.499511150.499693010.5045322410082681
0.499900860.499603730.505640130.5056669813340785
0.497059870.498149360.499573920.508110833091858
0.499930850.496172510.499742960.5039551715512736
0.499784260.499717220.496960560.507697873678101
0.496535040.499702630.49987860.5048520611441512
0.499378380.499688260.499854440.5048642310657263
0.498826280.499624990.499608020.511661512230064
0.499341240.49900130.500767940.511839612053762
0.499544660.499095980.499937380.5038285915596544
0.499178730.499870090.496656420.506605598823446
0.502078690.499883990.496678850.505506617434673
0.499432050.496211380.499702570.505382899229834
0.497591280.507215980.499750670.511974832376937
0.496471180.499821920.499150390.506686286353793
0.498374420.499440450.498693930.511930882044190
0.499020620.499122870.497534090.512646651519272
0.497721470.499543720.499600890.509738622019959
0.49610410.499941090.499161730.5033700425146433
0.499478620.49984050.496563690.50737485290801
0.499584540.499710570.499619260.510071573465449
0.49981830.499172080.499458830.508315984215360
0.499794280.499958750.499873330.5038890419075431
0.499767720.497094720.499643080.508485963310342
0.497299280.49931850.499648950.513346992381950
0.496703680.499427890.49975790.506414416004097
0.499861380.497626550.497983540.508723172831748
0.499018970.498685030.496954410.504694915884911
0.499501330.497372430.497236550.50994952551973
0.499855610.499464490.499885950.505411056474406
0.497668290.499469150.497349610.507312395217714
0.499932950.507349490.499860710.5059435113018026
0.497819140.49988190.496368350.505310839078023
0.497716860.499418610.498051430.509411863102566
0.500793890.49662190.499618170.505505338678420
0.49744950.496250180.49775160.504919438623188
0.499597590.49636110.499707620.5039195211324424
0.499525750.49968130.500852510.5041352618539404
?????
平均值????
0.499247070.499464970.499149410.507187227363639.96

200-250 數(shù)據(jù)

C-HC-HC-HC-C迭代次數(shù)
0.4992560.499788960.49987840.505805028163666
0.49969870.49769570.499767810.508709265066376
0.499150150.499729560.496975070.510200274023965
0.495863260.497102720.496730990.5050122213078461
0.498790410.499386820.499831640.506008586092068
0.49970370.497229440.499696950.509839563791700
0.499512180.499436880.499422410.512602362066943
0.496757050.499687140.499837210.5040957715623102
0.499396020.499004440.499498290.515293991617633
0.499766540.496531240.499431430.505020318577220
0.497923760.497254290.498487280.506862743139492
0.499821190.499327020.497007040.505162287300319
0.499610760.497359070.497669430.510159982247523
0.508769920.497114670.499648890.507712414142136
0.499767660.49971670.499237860.506167575196732
0.499674240.498212420.499589170.506470895328400
0.499647250.499576630.502876950.514163822424156
0.499830270.498816040.499266110.508911292774508
0.499138460.499618220.497276950.507729143891710
0.498052280.499432310.497615510.511412682149272
0.497494710.50087450.502520680.510262554357049
0.499225290.499478390.49621090.5043450311063466
0.499886860.499907540.508168850.5052401311310599
0.499791160.501261290.497221980.510955233604632
0.49713040.502102830.498123230.507411846286459
0.497698010.499767070.497409010.508501324242850
0.496958510.497198860.497458260.507197023966772
0.504382340.499891040.499901840.5031063323149348
0.499535780.499711740.499685080.507321565479617
0.499806390.499217440.497064870.506076154427723
0.496586310.498289140.499455230.505307216159655
0.49823080.496495430.499413240.505454658655550
0.499554460.500329660.499762470.511352073229716
0.499929380.509397610.499819920.5062436210733399
0.499590080.49756210.49956560.510794012086133
0.499754860.499725470.499828330.505103549411956
0.499194480.49958840.501151650.513172352203456
0.499884950.499494960.499807220.505516057542107
0.496991260.499146860.498482350.509673092951194
0.499749640.499671160.499680530.510809723474515
0.504935420.499786730.503501620.510576773822222
0.500982710.499589280.499541730.510373772222614
0.499568060.496718720.499693410.505737747676029
0.499543150.498634160.499146660.509274673417552
0.499964230.499963830.498917450.5050712919860832
0.499858470.499732220.498850290.504990256494884
0.499242640.502072980.498273280.515393661204440
0.499919250.498812440.499857620.5033693216873586
0.4997710.499892930.499815760.5043038113989672
0.497385810.499834610.499850690.507142357255895
?????
平均值????
0.499453520.499323390.49935850.507948346476986.08

250-300數(shù)據(jù)

C-HC-HC-HC-C迭代次數(shù)
0.499596910.497535780.499805580.506510935361356
0.49972560.499769610.499179290.5075853733106
0.499434540.498300890.49949340.508516243500494
0.499442650.497347510.50375260.508811923562963
0.499415990.496408330.499805420.5030842715055812
0.499498950.499841970.496822460.505269728893902
0.507572670.499925930.499929530.504322216562769
0.497970430.499262650.503010920.514758691915946
0.499778690.499616910.499789760.508178044824574
0.499771840.499751230.499707260.508710833629282
0.499520370.499408180.499536460.511091072010113
0.499577670.499880430.499646490.5043306910858543
0.499439080.497153530.499445050.508209024480260
0.499529340.49967190.49994580.5041147314212298
0.498902370.498518560.500308010.511293522525146
0.497986060.49795140.498644060.512184911755622
0.502538010.504604590.503410670.508264365822226
0.496823230.499699920.499750450.505584737023190
0.497985920.499404340.499900220.506836817745393
0.499863360.496230170.499683180.5047469310435763
0.49934640.499626290.499868880.5039066311231782
0.49981930.495852870.49988740.5042070217640182
0.501731410.497669790.496878980.505678885424604
0.499675420.4995280.504813420.508007032720932
0.499849220.497251660.499036390.5057159410642651
0.496417060.499725780.499909420.505120589093079
0.499686170.499766470.499897830.506411047881534
0.499649310.497405090.499624530.511068212527487
0.499824280.497496730.49583980.5026278524150796
0.498459020.499607750.49756060.5105992316161
0.499751830.499633590.503086650.509144275346513
0.499110420.498461710.499444750.50893543183331
0.497590710.499820490.498027230.5051448210100608
0.49582250.497540650.499546580.5024610536577408
0.499041030.499814430.497788760.505398618227345
0.507656170.499416170.499032860.506928963585950
0.499772510.49995090.499896930.5041644316536102
0.49992650.499860650.499169350.5034718418219040
0.501738840.499720580.49649220.504155612205386
0.49844390.499578450.499551830.505167765308414
0.499684590.499666220.49966430.510454192794275
0.499823470.500180990.496740330.505944626448910
0.502849140.496960070.499208580.5064774924449
0.498924750.498793690.498234140.506318757085646
0.496959490.499126850.49989030.5042720612981346
0.49953560.499716580.497556130.508751644311841
0.499398040.499777710.499264940.506578674997403
0.498837690.499888180.499932150.5053365914492407
0.49828690.499425570.499284470.512286251551059
0.502257470.50560630.498426250.5046042813692743
?????
平均值????
0.499684860.499143080.499502450.506834878402162.84


C2H6 r=0.001數(shù)據(jù)

0-50

C-HC-HC-HC-C迭代次數(shù)
0.497494460.499575360.499460960.5124674822614665
0.499807720.499871090.496069980.50505217110026256
0.499773650.499782180.499566390.5044610187786624
0.499877110.501768030.499664030.50454106106554686
0.499778250.499674050.499462040.5078757333331478
0.499391990.496899860.499647340.5088091632968752
0.501845620.496671430.502407720.50499657105553585
0.498286580.499834330.499750360.5051213972404234
0.499807430.498266570.499771230.5050863983880385
0.499939230.499885880.499925420.50533339136962605
0.497542620.497293920.500010750.5087540227648484
0.497013070.498582910.49968190.5089446236614282
0.499610790.496704590.499534550.5064799872314255
0.499323840.499453540.499206660.5157040717554375
0.505499160.498584250.501871250.5098708435081540
0.506829360.497482340.499943230.50325129232855840
0.499157060.499550570.499494810.5121591820581557
0.499565030.499749630.499612940.5071234154313799
0.504644090.499641580.49750980.5106486423545975
0.499293640.500086850.498169020.508071640958452
0.499769010.49982920.496775790.5064713956764697
0.498613540.500376480.499501180.5098091924925075
0.498428050.497080050.506357080.5124271317351287
0.504678320.498374350.49898430.5078337538433810
0.498856390.499119470.495942740.5052613281109812
0.499720790.499843080.49987430.5058246983157203
0.499936520.499742080.500727460.50377711133503548
0.498117410.49942880.499311640.5141588713693201
0.498267870.498862670.498885590.5132731521686777
0.499504510.499729140.499611690.5058104660441590
0.497109270.499790830.499722170.5063245473647489
0.499948790.499949350.499932230.50501073154907355
0.499822130.49989560.49974090.5060676473415523
0.499724450.499665960.499106740.508163735696278
0.499935060.499430830.496155820.50373334157182218
0.49621190.497452350.499680830.50385644130342272
0.49982220.499868460.496786950.5064208765399773
0.503033430.507291520.499609420.5123660321167419
0.499255380.499652160.499717880.5064037967697131
0.499859530.499439080.496493260.5048109282973398
0.496829830.498800770.499512530.5062234481067360
0.499808770.498881570.496631690.5059442245448715
0.496889060.499549760.500858380.5101804834016740
0.499510060.497308750.499007140.5097058724787525
0.500621730.498816670.497893690.5122010816870284
0.499784210.499542030.504564610.5100314333985173
0.499048050.498476110.499899180.50364317208925714
0.499794680.499746770.498900560.5070697142761438
0.499877460.497215770.499824930.5054043669809679
0.499555780.498820910.497461530.5099438818409192
?????
平均值????
0.49973630.499226790.499364650.5076580966462590.1


總結(jié)

以上是生活随笔為你收集整理的学习率对神经网络的影响-乙烷,乙烯,乙炔的分子模型试验数据对比的全部內(nèi)容,希望文章能夠幫你解決所遇到的問題。

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