Search

Current filters:
Add filters:
  • previous
  • 1
  • next
Item hits:
PreviewTitleAuthor(s)ProgramMethod(s)Basis SetEnergySolv.Vibr.
thumbnail.jpeg/Acrolein_1Propenol TS_1propenol_1propenolHRellán, Marcosvasp; 5.3.5; 31Mar14 (build May 07 2014 16:01:45) complexPBE+U--1132.46846598; eV
thumbnail.jpeg/Acrolein_1Propenol TS_Acrolein_1PropenolRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1131.40510419; eV
thumbnail.jpeg/Acrolein_2Propenol TS_2propenol_2propenolHRellán, Marcosvasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complexPBE+U--1132.05189141; eV
thumbnail.jpeg/Acrolein_2Propenol TS_Acrolein_2PropenolRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1131.47126375; eV
thumbnail.jpeg/2Propenol_Propylene TS_2propenolH_2propenolRellán, Marcosvasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complexPBE+U--1132.05189141; eV
thumbnail.jpeg/2Propenol_Propylene TS_2Propenol_PropyleneRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1131.12053134; eV
thumbnail.jpeg/Propen2ol_Propanone TS_P2olH_P2olRellán, Marcosvasp; 5.3.3; 18Dez12 (build Apr 2 2013 14:53:31) complexPBE+U--1132.50405552; eV
thumbnail.jpeg/Propen2ol_Propanone TS_P2ol_1PropanoneRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1132.32750753; eV
thumbnail.jpeg/1Propenol_Propanal TS_1Propenol_PropanalRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1132.70372462; eV
thumbnail.jpeg/1Propenol_Propanal TS_1propenolH_1propenolRellán, Marcosvasp; 5.3.5; 31Mar14 (build May 07 2014 16:01:45) complexPBE+U--1132.46846598; eV
thumbnail.jpeg/Propen2ol_Propanone PropanoneRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1133.95508610; eV
thumbnail.jpeg/Propen2ol_Propanone P2olRellán, Marcosvasp; 5.3.3; 18Dez12 (build Jan 17 2013 15:17:09) complexPBE+U--1132.98197065; eV
thumbnail.jpeg/Propen2ol_Propanone P2olHRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1133.07065208; eV
thumbnail.jpeg/Acrolein_2Propenol 2propenolHRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1132.64342758; eV
thumbnail.jpeg/Acrolein_2Propenol AcroleinRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1132.69760451; eV
thumbnail.jpeg/Acrolein_2Propenol 2propenolRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1132.38419771; eV
thumbnail.jpeg/2Propenol_Propylene 2propenolRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1132.07220340; eV
thumbnail.jpeg/2Propenol_Propylene PropyleneRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1132.43692081; eV
thumbnail.jpeg/2Propenol_Propylene 2propenolHRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1132.64342758; eV
thumbnail.jpeg/Acrolein_1Propenol AcroleinRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1132.32725131; eV
thumbnail.jpeg/Acrolein_1Propenol 1propenolHRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1132.98322866; eV
thumbnail.jpeg/Acrolein_1Propenol 1propenolRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1132.82329330; eV
thumbnail.jpeg/1Propenol_Propanal 1propenolHRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1132.98322866; eV
thumbnail.jpeg/1Propenol_Propanal PropanalRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1133.52415019; eV
thumbnail.jpeg/1Propenol_Propanal 1propenolRellán, Marcosvasp; 5.3.3; 18Dez12 (build Mar 2 2016 16:13:58) complexPBE+U--1132.82329330; eV
  • previous
  • 1
  • next
Results 1-25 of 25 (Search time: 0.018 seconds).

Discover

Method
Program name
Calculation type