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PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpeg/Methylations 2,4-TDAdiss+DMCdissRellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1335.39573171; eV
thumbnail.jpeg/Methylations TS_2,4-TDARellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1334.59158561; eV
thumbnail.jpeg/Methylations MeTDA2_adsRellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1336.71142080; eV
thumbnail.jpeg/2,4-TDA_to_MC2 p-2,4-TDA_diss+DMC_dissRellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1335.48459667; eV
thumbnail.jpeg/2,4-TDA_to_MC2 MC2_adsorbedRellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1335.95718730; eV
thumbnail.jpeg/2,4-TDA_to_MC2 TS2Rellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1335.19521056; eV
thumbnail.jpeg/MC2_to_BC MC2_adsRellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1336.01616019; eV
thumbnail.jpeg/MC2_to_BC MC2_dissRellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1335.52389257; eV
thumbnail.jpeg/MC2_to_BC TS1Rellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1335.49702340; eV
thumbnail.jpeg/MC1_to_BC MC1_adsRellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1336.04907088; eV
thumbnail.jpeg/MC1_to_BC MC1_dissRellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1335.51666807; eV
thumbnail.jpeg/MC1_to_BC TS1Rellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1335.49082139; eV
thumbnail.jpeg/PU1_formation MC2_adsRellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1336.03584050; eV
thumbnail.jpeg/PU1_formation MC2_dissRellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build May 11 2017 09:55:02) gamma-onlyDFT--1336.27152754; eV
thumbnail.jpeg/PU1_formation TS_MC2-dissRellán, Marcosvasp; 5.4.4; 18Apr17-6-g9f103f2a35 (build Jun 30 2017 19:19:18) complexDFT--1335.82632750; eV
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