Structural studies on choline-carboxylate bio-ionic liquids by x-ray scattering and molecular dynamics

Interaction and dynamics of ionic liquids based on choline and amino acid anions

(2015) M. Campetella et al.   JOURNAL OF CHEMICAL PHYSICS

Is a medium-range order pre-peak possible for ionic liquids without an aliphatic chain?

(2015) Marco Campetella et al.   RSC Advances

Vibrations of Bioionic Liquids by Ab Initio Molecular Dynamics and Vibrational Spectroscopy

(2014) Luana Tanzi et al.   JOURNAL OF PHYSICAL CHEMISTRY A

Bicontinuity and Multiple Length Scale Ordering in Triphilic Hydrogen-Bonding Ionic Liquids

(2014) Jeevapani J. Hettige et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Amino Acid Anions in Organic Ionic Compounds. An ab Initio Study of Selected Ion Pairs

(2014) A. Benedetto et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Structure of 1-Alkyl-1-methylpyrrolidinium Bis(trifluoromethylsulfonyl)amide Ionic Liquids with Linear, Branched, and Cyclic Alkyl Groups

(2013) Hemant K. Kashyap et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Structure and Aggregation in the 1-Alkyl-3-Methylimidazolium Bis(trifluoromethylsulfonyl)imide Ionic Liquid Homologous Series

(2013) Karina Shimizu et al.   JOURNAL OF PHYSICAL CHEMISTRY B

SAXS anti-peaks reveal the length-scales of dual positive–negative and polar–apolar ordering in room-temperature ionic liquids

(2012) Hemant K. Kashyap et al.   CHEMICAL COMMUNICATIONS

Choline based ionic liquids: Interfacial properties of RTILs with strong hydrogen bonding

(2012) José Restolho et al.   FLUID PHASE EQUILIBRIA

Low melting mixtures in organic synthesis – an alternative to ionic liquids?

(2012) Carolin Ruß et al.   GREEN CHEMISTRY

Synthesis and Physical Properties of Choline Carboxylate Ionic Liquids

(2012) Nawshad Muhammad et al.   JOURNAL OF CHEMICAL AND ENGINEERING DATA

Liquid Structure of 1-Ethyl-3-methylimidazolium Alkyl Sulfates by X-ray Scattering and Molecular Dynamics

(2012) Marina Macchiagodena et al.   JOURNAL OF PHYSICAL CHEMISTRY B

The Interpretation of Diffraction Patterns of Two Prototypical Protic Ionic Liquids: a Challenging Task for Classical Molecular Dynamics Simulations

(2012) Lorenzo Gontrani et al.   JOURNAL OF PHYSICAL CHEMISTRY B

A Computational Study on Choline Benzoate and Choline Salicylate Ionic Liquids in the Pure State and After CO2 Adsorption

(2012) Santiago Aparicio et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Choline-Based Ionic Liquids on Graphite Surfaces and Carbon Nanotubes Solvation: A Molecular Dynamics Study

(2012) Santiago Aparicio et al.   Journal of Physical Chemistry C

Anions, the Reporters of Structure in Ionic Liquids

(2012) Jeevapani J. Hettige et al.   Journal of Physical Chemistry Letters

TRAVIS - A Free Analyzer and Visualizer for Monte Carlo and Molecular Dynamics Trajectories

(2011) Martin Brehm et al.   Journal of Chemical Information and Modeling

Liquid structure of 1-alkyl-3-methylimidazolium-hexafluorophosphates by wide angle x-ray and neutron scattering and molecular dynamics

(2011) Marina Macchiagodena et al.   JOURNAL OF CHEMICAL PHYSICS

Temperature-dependent structure of methyltributylammonium bis(trifluoromethylsulfonyl)amide: X ray scattering and simulations

(2011) Cherry S. Santos et al.   JOURNAL OF CHEMICAL PHYSICS

Thermal and Structural Properties of Ethylammonium Chloride and Its Mixture with Water

(2011) Valentina Migliorati et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Thermotropic Phase Behavior of Choline Soaps

(2011) Regina Klein et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Mesoscopic Structural Heterogeneities in Room-Temperature Ionic Liquids

(2011) Olga Russina et al.   Journal of Physical Chemistry Letters

Selected chemical–physical properties and structural heterogeneities in 1-ethyl-3-methylimidazolium alkyl-sulfate room temperature ionic liquids

(2010) Olga Russina et al.   CHEMICAL PHYSICS LETTERS

Ionic liquids: a pathway to environmental acceptability

(2010) Marija Petkovic et al.   CHEMICAL SOCIETY REVIEWS

Spotlight on ionic liquids

(2010) Edward W. Castner et al.   JOURNAL OF CHEMICAL PHYSICS

What is the Origin of the Prepeak in the X-ray Scattering of Imidazolium-Based Room-Temperature Ionic Liquids?

(2010) Harsha V. R. Annapureddy et al.   JOURNAL OF PHYSICAL CHEMISTRY B

An energy dispersive x-ray scattering and molecular dynamics study of liquid dimethyl carbonate

(2009) Lorenzo Gontrani et al.   JOURNAL OF CHEMICAL PHYSICS

Aten-An application for the creation, editing, and visualization of coordinates for glasses, liquids, crystals, and molecules

(2009) T. G. A. Youngs   JOURNAL OF COMPUTATIONAL CHEMISTRY

PACKMOL: A package for building initial configurations for molecular dynamics simulations

(2009) L. Martínez et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

A study of cyclohexane, piperidine and morpholine with X-ray diffraction and molecular simulations

(2007) Lorenzo Gontrani et al.   JOURNAL OF MOLECULAR LIQUIDS