Ab initio calculations and molecular dynamics simulations for imidazolium - [Tf2N] ionic liquids

Microscopic structure and thermodynamic properties

Ioannis Economou, Georgia Evangelia Logotheti, Javier Ramos, Alexander Vanin

Research output: Chapter in Book/Report/Conference proceedingConference contribution

Original languageEnglish
Title of host publicationAIChE100 - 2008 AIChE Annual Meeting, Conference Proceedings
Publication statusPublished - 2008
Externally publishedYes
Event2008 AIChE Annual Meeting, AIChE 100 - Philadelphia, PA, United States
Duration: 16 Nov 200821 Nov 2008

Other

Other2008 AIChE Annual Meeting, AIChE 100
CountryUnited States
CityPhiladelphia, PA
Period16/11/0821/11/08

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Ionic Liquids
Ionic liquids
Molecular dynamics
Thermodynamic properties
Computer simulation

ASJC Scopus subject areas

  • Chemical Engineering(all)
  • Chemistry(all)

Cite this

Economou, I., Logotheti, G. E., Ramos, J., & Vanin, A. (2008). Ab initio calculations and molecular dynamics simulations for imidazolium - [Tf2N] ionic liquids: Microscopic structure and thermodynamic properties. In AIChE100 - 2008 AIChE Annual Meeting, Conference Proceedings

Ab initio calculations and molecular dynamics simulations for imidazolium - [Tf2N] ionic liquids : Microscopic structure and thermodynamic properties. / Economou, Ioannis; Logotheti, Georgia Evangelia; Ramos, Javier; Vanin, Alexander.

AIChE100 - 2008 AIChE Annual Meeting, Conference Proceedings. 2008.

Research output: Chapter in Book/Report/Conference proceedingConference contribution

Economou, I, Logotheti, GE, Ramos, J & Vanin, A 2008, Ab initio calculations and molecular dynamics simulations for imidazolium - [Tf2N] ionic liquids: Microscopic structure and thermodynamic properties. in AIChE100 - 2008 AIChE Annual Meeting, Conference Proceedings. 2008 AIChE Annual Meeting, AIChE 100, Philadelphia, PA, United States, 16/11/08.
Economou, Ioannis ; Logotheti, Georgia Evangelia ; Ramos, Javier ; Vanin, Alexander. / Ab initio calculations and molecular dynamics simulations for imidazolium - [Tf2N] ionic liquids : Microscopic structure and thermodynamic properties. AIChE100 - 2008 AIChE Annual Meeting, Conference Proceedings. 2008.
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