[{"formula":"H256O128","reaction":"hydrogen","method":"M3GNet","natoms":384,"total_time_seconds":83435.158906,"total_steps":119000,"target_steps":2000000,"steps_per_second":1.4262572465,"seconds_per_step":0.7011357891,"timesteps":[999,1999,2999,3999,4999,5999,6999,7999,8999,9999,10998,11998,12998,13998,14998,15998,16998,17998,18997,19997,20997,21997,22997,23996,24996,25996,26996,27996,28996,29996,30995,31995,32995,33995,34995,35995,36995,37995,38995,39994,40994,41994,42994,43994,44994,45993,46993,47993,48993,49993,50993,51993,52993,53993,54992,55992,56992,57992,58992,59992,60992,61992,62992,63991,64991,65991,66991,67991,68991,69991,70991,71991,72990,73990,74990,75990,76990,77990,78990,79990,80990,81989,82989,83989,84989,85989,86989,87989,88989,89989,90988,91988,92988,93988,94988,95988,96988,97988,98988,99987,100987,101987,102987,103987,104987,105987,106987,107987,108986,109986,110986,111986,112986,113986,114986,115986,116986,117985,118985,119985,120985,121985,122985,123985,124985,125985,126984,127984,128984,129984,130984,131984,132984,133984,134984],"nproducts":[0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0,0],"temperatures":[278.1618454477,283.696969209,303.6755464429,349.5712837869,322.6792603837,320.1010124872,312.7914613875,343.1849520658,327.7918844722,342.4570786966,317.6770535806,355.3462360308,334.8206442046,325.9879295542,345.4902922437,356.6987097928,391.1899374174,383.9048559001,350.6951495873,386.7836496123,382.6304424835,391.7035645393,410.0847022534,407.5474298038,390.6640401299,373.9615717633,418.8857020464,414.9326660162,394.4006858238,435.3612084608,426.4742325229,448.3010689935,444.4500224707,457.1614101777,474.5074430189,431.4959959882,407.8796622098,476.0885660253,473.770885575,451.3995183693,468.9214564249,455.5713467755,465.9930284562,446.994557228,501.2518002119,502.6081613348,501.7212826822,524.5671460643,504.2731318509,503.9600696525,486.7314483927,469.7956842017,504.6396365038,522.6636189139,509.1293033942,540.2430361317,546.673250177,522.759263918,552.3367774569,533.497120913,538.5284638521,538.3978274485,544.4310925162,527.308070579,539.3767949235,526.0886665558,541.2636654222,530.89957282,588.4385162791,543.9106350856,560.1323787042,615.5123819499,621.2413306086,580.0873353689,587.8160383595,545.2519242396,603.7043291997,648.5760826504,674.4786549021,584.6190971509,642.1336615551,647.1542620004,592.9648808674,582.766701956,620.0449884406,624.733977393,698.9051867746,672.339497206,687.7308911012,636.7815960621,694.5179389408,728.9889597881,714.4910461444,692.6975355683,641.1826025147,692.3766822593,685.1195590012,724.7861705709,709.2592669589,691.9239263211,720.7035466897,695.7271034251,690.8515978878,696.4341912147,756.2999315792,767.1245371248,774.7274902732,771.4432599893,726.5103981905,744.6891267052,778.1116202041,793.0154886917,790.8507599525,743.3220228874,745.0126487985,787.683055617,736.6259030744,834.6221542025,759.2199028819,768.9193311668,811.9237322627,821.3378705369,776.771721291,770.1615289628,783.4587640949,789.8370779871,819.4838282011,804.6149121328,868.0930957388,780.9802300112,844.7505961934,771.5882173873,896.482752413,849.0502409404,821.9184775542],"pressures":[0.034365536,0.0240053705,0.0285419368,0.043391098,0.036271515,0.0242560674,0.0245244065,0.0255612237,0.0587010644,0.0447296066,0.0455238,0.0534456919,0.031148673,0.0278920402,0.0336758569,0.0712907501,0.0617837335,0.0315673252,0.0680944324,0.0308707914,0.0401130505,0.0103924302,0.0487769557,0.0377368977,0.0102963299,0.0244089421,0.0470916629,0.0365938069,0.012004282,0.0407204914,0.0513731577,0.0547796264,0.0574332227,0.0366204213,0.0552931353,0.0368541901,0.0205456348,0.0424872227,0.0297305298,0.0156669095,0.0369472324,0.0449818124,0.0283406138,0.0007157391,0.0408773577,0.0570698865,0.0690986502,0.0636860815,0.0418454086,0.0254167744,0.0030708707,0.0472546443,0.0647528805,0.0699872424,0.0527485013,0.0628145051,0.0330205609,0.0555929281,0.0204227346,0.0314565462,-0.016260795,0.0811107531,0.040553463,-0.0051910576,0.0188516943,0.0172696205,0.0663014812,0.0333774779,0.0686365664,0.0621827319,0.0462006355,0.0735480189,0.0549990938,0.0558528764,0.0516521037,0.0778511092,0.0911203176,0.0832976426,0.0564351979,0.0466385333,0.0917298347,0.0386600898,0.0726240625,0.1037453214,0.0765941056,0.0949090943,0.0381118469,0.0482941599,0.0532862035,0.0509293427,0.0722911668,0.0995764956,0.0693256973,0.0321525484,0.0558058694,0.0774484773,0.0512790841,0.0690419953,0.0384434263,0.0518378519,0.1000820771,0.0707188596,0.0805606879,0.0911611368,0.063506941,0.0554484936,0.0918639675,0.0799755926,0.0739149551,0.097187986,0.0554729799,0.0886866798,0.1000536904,0.0163868642,0.0962056878,0.0573375585,0.0884027469,0.0937420775,0.0807350675,0.0661216397,0.0663308489,0.0508430252,0.0844746468,0.1152142783,0.072244525,0.0852520317,0.1147154321,0.1152807822,0.090510125,0.1314529081,0.0935921495,0.0635601214,0.0903189294,0.075362208,0.0696567229],"seconds_per_step_per_atom":0.0018258745}]