GMTKN55 BSR36 ------------- References ^^^^^^^^^^ | GMTKN55: https://www.chemie.uni-bonn.de/grimme/de/software/gmtkn/gmtkn55 | L. Goerigk, A. Hansen. C. A. Bauer, S. Ehrlich, A. Najibi and S. Grimme in Phys. Chem. Chem. Phys., 2017: https://doi.org/10.1039/C7CP04913G Molecules ^^^^^^^^^ h10 c2h6 h11 r14 r13 h2 h5 r12 r15 h4 h3 c1 r7 r9 r8 r1 r6 h13 h14 ch4 h15 h12 h6 h1 h8 r10 h9 h7 r16 r11 c3 c4 c5 c2 r3 r4 r5 r2 Reactions ^^^^^^^^^ | 1: h1 + 4ch4 -> 5c2h6, energy = 0.015202957737599998 | 2: h2 + 4ch4 -> 5c2h6, energy = 0.01513921368 | 3: h3 + 4ch4 -> 5c2h6, energy = 0.0176730399696 | 4: h4 + 4ch4 -> 5c2h6, energy = 0.014103372744 | 5: h5 + 4ch4 -> 5c2h6, energy = 0.013768716441600002 | 6: h6 + 5ch4 -> 6c2h6, energy = 0.0172268315664 | 7: h7 + 5ch4 -> 6c2h6, energy = 0.0203024823456 | 8: h8 + 5ch4 -> 6c2h6, energy = 0.018645136848 | 9: h9 + 5ch4 -> 6c2h6, energy = 0.021035539008 | 10: h10 + 5ch4 -> 6c2h6, energy = 0.0176411679408 | 11: h11 + 5ch4 -> 6c2h6, energy = 0.0199040819856 | 12: h12 + 5ch4 -> 6c2h6, energy = 0.019680977784 | 13: h13 + 5ch4 -> 6c2h6, energy = 0.017513679825600002 | 14: h14 + 5ch4 -> 6c2h6, energy = 0.0156651021552 | 15: h15 + 6ch4 -> 7c2h6, energy = 0.0227406925488 | 16: r1 + 5ch4 -> 5c2h6, energy = 0.0035696672256000004 | 17: r2 + 6ch4 -> 6c2h6, energy = 0.016828431206400003 | 18: r3 + 6ch4 -> 6c2h6, energy = 0.0097369047984 | 19: r4 + 7ch4 -> 7c2h6, energy = 0.0233781331248 | 20: r5 + 7ch4 -> 7c2h6, energy = 0.0162706707024 | 21: r6 + 7ch4 -> 7c2h6, energy = 0.015585422083199999 | 22: r7 + 7ch4 -> 7c2h6, energy = 0.0138962045568 | 23: r8 + 7ch4 -> 7c2h6, energy = 0.016095374544 | 24: r9 + 7ch4 -> 7c2h6, energy = 0.015091405636800002 | 25: r10 + 12ch4 -> 11c2h6, energy = 0.029561306712000003 | 26: r11 + 12ch4 -> 11c2h6, energy = 0.014230860859199999 | 27: r12 + 12ch4 -> 11c2h6, energy = 0.023202836966400003 | 28: r13 + 12ch4 -> 11c2h6, energy = 0.0406687087488 | 29: r14 + 12ch4 -> 11c2h6, energy = 0.036429728918399996 | 30: r15 + 14ch4 -> 13c2h6, energy = 0.04342563924 | 31: r16 + 12ch4 -> 12c2h6, energy = 0.039776291942400004 | 32: c1 + 14ch4 -> 12c2h6, energy = 0.0427403906208 | 33: c2 + 16ch4 -> 14c2h6, energy = 0.06109867920960001 | 34: c3 + 16ch4 -> 14c2h6, energy = 0.0495450687696 | 35: c4 + 18ch4 -> 16c2h6, energy = 0.0793932237408 | 36: c5 + 22ch4 -> 18c2h6, energy = 0.07244512146240001