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chemistry, physical (143) 143
ionic liquids (99) 99
thermodynamics (66) 66
1-alkyl-3-methylimidazolium cations (65) 65
physics, atomic, molecular & chemical (60) 60
ionische flüssigkeit (56) 56
ionic liquid (43) 43
ionic-liquid (43) 43
analysis (42) 42
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anions (37) 37
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water (37) 37
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1-alkyl-3-methylimidazolium bromide (31) 31
engineering, chemical (30) 30
solvents (30) 30
1-n-butyl-3-methylimidazolium hexafluorophosphate (29) 29
anion (28) 28
mixtures (27) 27
chemistry, multidisciplinary (26) 26
molecular dynamics (26) 26
physical-properties (26) 26
index medicus (25) 25
1-alkyl-3-methylimidazolium (24) 24
physicochemical properties (24) 24
binary-mixtures (23) 23
1-alkyl-3-methylimidazolium tetrafluoroborate (21) 21
chemistry (21) 21
temperature molten-salts (21) 21
tetrafluoroborate (21) 21
aqueous-solutions (20) 20
imidazolium (20) 20
viscosity (20) 20
phase-behavior (19) 19
chemistry, analytical (18) 18
fluorides (18) 18
temperature ionic liquids (18) 18
imidazoles - chemistry (17) 17
ionic liquids - chemistry (17) 17
kation (17) 17
solubility (17) 17
molecular-dynamics (16) 16
chemical properties (15) 15
electric properties (15) 15
salts (15) 15
transport-properties (15) 15
1-alkyl-3-methylimidazolium-based ionic liquids (14) 14
carbon-dioxide (14) 14
physical chemistry (14) 14
separation (14) 14
solvation (14) 14
molecular structure (13) 13
molecular-dynamics simulation (13) 13
thermophysical properties (13) 13
1,3-dimethylimidazolium chloride (12) 12
aggregation behavior (12) 12
biochemical research methods (12) 12
electrolytes (12) 12
hexafluorophosphate (12) 12
molten-salts (12) 12
simulation (12) 12
surface-tension (12) 12
1-alkyl-3-methylimidazolium propionate (11) 11
atom force-field (11) 11
liquids (11) 11
mathematical analysis (11) 11
particle mesh ewald (11) 11
usage (11) 11
1-alkyl-3-methylimidazolium chloride (10) 10
dynamics (10) 10
environmental sciences (10) 10
mathematical models (10) 10
molekulardynamische simulation (10) 10
oberflächenspannung (10) 10
polymer science (10) 10
systems (10) 10
volumetric properties (10) 10
zweistoffgemisch (10) 10
1-butyl-3-methylimidazolium hexafluorophosphate (9) 9
1-butyl-3-methylimidazolium tetrafluoroborate (9) 9
catalysis (9) 9
chloride (9) 9
computer simulation (9) 9
conductivity (9) 9
electrochemical properties (9) 9
enthalpy (9) 9
extraction (9) 9
ions (9) 9
phasenverhalten (9) 9
surfactants (9) 9
1-ethyl-3-methylimidazolium tetrafluoroborate (8) 8
acetates (8) 8
aqueous solutions (8) 8
aqueous-solution (8) 8
cation (8) 8
chains (8) 8
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The Journal of Physical Chemistry C, ISSN 1932-7447, 01/2013, Volume 117, Issue 1, pp. 205 - 212
We have carried out differential capacitance measurements and in-situ scanning tunneling microscope (STM) characterizations to investigate the effect of the... 
ELECTROCHEMISTRY | TEMPERATURE | CONDUCTIVITY | RECONSTRUCTION | MATERIALS SCIENCE, MULTIDISCIPLINARY | IN-SITU STM | CHEMISTRY, PHYSICAL | GLASSY-CARBON | NANOSCIENCE & NANOTECHNOLOGY | DIFFERENTIAL CAPACITANCE | 1-ALKYL-3-METHYLIMIDAZOLIUM TETRAFLUOROBORATE | ELECTRODEPOSITION
Journal Article
The Journal of Chemical Thermodynamics, ISSN 0021-9614, 2011, Volume 43, Issue 3, pp. 339 - 343
The high-pressure phase behaviour of the binary system {1-ethyl-methylimidazolium tetrafluoroborate ([EMIM][BF ]) + CO } was determined over the temperature... 
Phase equilibrium | 1-Alkyl-3-methylimidazolium tetrafluoroborate | VLE | Carbon dioxide | VLLE | 1-Alkyl-3-methylimidazolium | CHEMISTRY, PHYSICAL | SOLUBILITY | PRESSURE | THERMODYNAMICS | TEMPERATURE | SYSTEMS | tetrafluoroborate | IONIC LIQUIDS | Measurement | Fluorides | Correlation | Liquids | Binary systems | Chains | Moles | Cations | Mixing rules | Vapour
Journal Article
Journal of Chemical & Engineering Data, ISSN 0021-9568, 03/2016, Volume 61, Issue 3, pp. 1078 - 1091
The branched ionic liquids (ILs) 1-(iso-alkyl)-3-methylimidazolium bis­[(trifluoromethane)­sulfonyl]­amide ([(N – 2)­mC N‑1C1im]­[NTf2] with N = 3–7) were... 
PHYSICAL-PROPERTIES | MOLECULAR-DYNAMICS | THERMODYNAMIC PROPERTIES | FICTIVE TEMPERATURE | TRANSPORT-PROPERTIES | THERMOPHYSICAL PROPERTIES | CHEMISTRY, MULTIDISCIPLINARY | ENGINEERING, CHEMICAL | GLASS-TRANSITION | THERMODYNAMICS | 1-ALKYL-3-METHYLIMIDAZOLIUM CATIONS | CATION SYMMETRY | HEAT-CAPACITIES
Journal Article
Physical Chemistry Chemical Physics, ISSN 1463-9076, 02/2013, Volume 15, Issue 5, pp. 1632 - 1646
Journal Article
ELECTROPHORESIS, ISSN 0173-0835, 10/2004, Volume 25, Issue 20, pp. 3450 - 3454
Journal Article
The Journal of Chemical Physics, ISSN 0021-9606, 11/2016, Volume 145, Issue 19, p. 191101
The recent predictions of the self-consistent generalized Langevin equation theory, describing the existence of unusual partially arrested states in the... 
MOLECULAR-DYNAMICS | GLASS-TRANSITION | THERMODYNAMICS | TEMPERATURE | 1-ALKYL-3-METHYLIMIDAZOLIUM CATIONS | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | CHEMISTRY, PHYSICAL | FORCE-FIELD | VISCOSITY | SIMULATION | Solvents | Diffusion rate | Anions | Molecular dynamics | Ionic liquids | Ions | Cations
Journal Article
Physical Chemistry Chemical Physics, ISSN 1463-9076, 01/2013, Volume 15, Issue 5, pp. 1632 - 1646
In this work, we assess several popular atomic partial charge schemes with the view of accurately quantifying charge distribution, dipole moments and charge... 
Anions | Chlorides | Ion pairs | Charge | Clusters | Charge transfer | Density | Dipole moment
Journal Article
The Journal of Physical Chemistry B, ISSN 1520-6106, 02/2008, Volume 112, Issue 6, pp. 1743 - 1751
Journal Article
The Journal of Physical Chemistry B, ISSN 1520-6106, 06/2016, Volume 120, Issue 25, pp. 5678 - 5690
In this work, we have performed molecular dynamics (MD) simulations to compare the structural and dynamical properties of three ionic liquids (ILs),... 
IMIDAZOLIUM CATION | STIMULUS-RESPONSE BEHAVIOR | SOLVENTS | PHASE-BEHAVIOR | 1-ALKYL-3-METHYLIMIDAZOLIUM CATIONS | CHEMISTRY, PHYSICAL | COMPUTER-SIMULATION | FORCE-FIELD | TEMPERATURE MOLTEN-SALTS | CRYSTALLINE VIOLOGEN | CHLORIDE | Molecular simulation | Ionic liquids | Molecular dynamics | Usage | Properties | Analysis
Journal Article
Journal of Chemical Physics, ISSN 0021-9606, 09/2011, Volume 135, Issue 12, pp. 124507 - 124507-16
Journal Article
Physical Chemistry Chemical Physics, ISSN 1463-9076, 01/2005, Volume 7, Issue 1, pp. 124 - 135
We report a molecular dynamics study of the solvation of 18-crown-6 ("18C6'') and of its K+, Cs+ and Sr2+ complexes in a room-temperature ionic liquid (IL)... 
1-ALKYL-3-METHYLIMIDAZOLIUM CATIONS | CRYSTAL-STRUCTURE | MOLTEN-SALTS | PHYSICS, ATOMIC, MOLECULAR & CHEMICAL | AB-INITIO CALCULATIONS | NEUTRON-DIFFRACTION | SUPERCRITICAL CO2 | CHEMISTRY, PHYSICAL | COMPUTER-SIMULATION | FORCE-FIELD | CROWN-ETHERS | 1-N-BUTYL-3-METHYLIMIDAZOLIUM HEXAFLUOROPHOSPHATE
Journal Article