| P50 | author | Edward J. Maginn | Q46859999 |
| P2093 | author name string | Hongjun Liu | |
| P2860 | cites work | Development and testing of a general amber force field | Q29547642 |
| | Development of complex classical force fields through force matching to ab initio data: application to a room-temperature ionic liquid | Q31034407 |
| | Molecular dynamic simulations of ionic liquids: a reliable description of structure, thermodynamics and dynamics | Q31133428 |
| | Electrochemistry of room temperature protic ionic liquids | Q31155816 |
| | Hydrophobic, Highly Conductive Ambient-Temperature Molten Salts | Q32019052 |
| | Effect of pressure on transport properties of the ionic liquid 1-butyl-3-methylimidazolium hexafluorophosphate | Q33436534 |
| | Simulations of ionic liquids, solutions, and surfaces | Q34698421 |
| | Understanding ionic liquids through atomistic and coarse-grained molecular dynamics simulations | Q36970564 |
| | Atomistic simulation of the thermodynamic and transport properties of ionic liquids | Q36978144 |
| | Ionicity in ionic liquids: correlation with ionic structure and physicochemical properties | Q37690143 |
| | Molecular simulation of ionic liquids: current status and future opportunities. | Q37915120 |
| | Modelling room temperature ionic liquids. | Q40069873 |
| | Molecular dynamics study of the temperature-dependent Optical Kerr effect spectra and intermolecular dynamics of room temperature ionic liquid 1-methoxyethylpyridinium dicyanoamide. | Q40083544 |
| | Simulations of imidazolium ionic liquids: when does the cation charge distribution matter? | Q42731337 |
| | Molecular force field for ionic liquids v: hydroxyethylimidazolium, dimethoxy-2- methylimidazolium, and fluoroalkylimidazolium cations and bis(fluorosulfonyl)amide, perfluoroalkanesulfonylamide, and fluoroalkylfluorophosphate anions | Q43154168 |
| | Fragility, Stokes-Einstein violation, and correlated local excitations in a coarse-grained model of an ionic liquid. | Q43166560 |
| | Are there stable ion-pairs in room-temperature ionic liquids? Molecular dynamics simulations of 1-n-butyl-3-methylimidazolium hexafluorophosphate | Q43261637 |
| | Molecular force field for ionic liquids IV: trialkylimidazolium and alkoxycarbonyl-imidazolium cations; alkylsulfonate and alkylsulfate anions. | Q44583236 |
| | Physicochemical properties, structure, and conformations of 1-Butyl-3-methylimidazolium bis(trifluoromethanesulfonyl)imide [C4mim]NTf2 ionic liquid | Q44970521 |
| | Structure of ionic liquids of 1-alkyl-3-methylimidazolium cations: a systematic computer simulation study | Q44989058 |
| | Single particle dynamics in ionic liquids of 1-alkyl-3-methylimidazolium cations | Q45215738 |
| | Polarizable force field development and molecular dynamics simulations of ionic liquids. | Q45917659 |
| | Atom substitution effects of [XF6]- in ionic liquids. 1. Experimental study. | Q45953367 |
| | Atom substitution effects of [XF6]- in ionic liquids. 2. Theoretical study. | Q45953369 |
| | Molecular dynamics simulation of imidazolium-based ionic liquids. I. Dynamics and diffusion coefficient | Q46204138 |
| | On the validity of Stokes-Einstein and Stokes-Einstein-Debye relations in ionic liquids and ionic-liquid mixtures. | Q46408289 |
| | Effect of pressure on the transport properties of ionic liquids: 1-alkyl-3-methylimidazolium salts. | Q46475775 |
| | Application of static charge transfer within an ionic-liquid force field and its effect on structure and dynamics | Q46493888 |
| | Molecular dynamics simulation of the energetic room-temperature ionic liquid, 1-hydroxyethyl-4-amino-1,2,4-triazolium nitrate (HEATN). | Q46742629 |
| | Structure of the liquid-vacuum interface of room-temperature ionic liquids: a molecular dynamics study | Q46938998 |
| | Molecular modeling and experimental studies of the thermodynamic and transport properties of pyridinium-based ionic liquids | Q46939193 |
| | Physicochemical properties and structures of room-temperature ionic liquids. 3. Variation of cationic structures | Q46939196 |
| | Refined potential model for atomistic simulations of ionic liquid [bmim][PF6]. | Q46987832 |
| | Ab initio molecular dynamics of liquid 1,3-dimethylimidazolium chloride. | Q50092276 |
| | Low frequency vibrational modes of room temperature ionic liquids. | Q50546041 |
| | Transport properties of the ionic liquid 1-ethyl-3-methylimidazolium chloride from equilibrium molecular dynamics simulation. The effect of temperature. | Q50722252 |
| | Molecular simulation study of some thermophysical and transport properties of triazolium-based ionic liquids. | Q51136487 |
| | Determining atom-centered monopoles from molecular electrostatic potentials. The need for high sampling density in formamide conformational analysis | Q51197836 |
| | Relations between the fractional Stokes-Einstein and Nernst-Einstein equations and velocity correlation coefficients in ionic liquids and molten salts. | Q51683700 |
| | On the concept of ionicity in ionic liquids. | Q51816806 |
| | Thermal conductivities of molecular liquids by reverse nonequilibrium molecular dynamics. | Q51937190 |
| | Physicochemical properties and structures of room temperature ionic liquids. 2. Variation of alkyl chain length in imidazolium cation. | Q51937308 |
| | Limitations and recommendations for the calculation of shear viscosity using reverse nonequilibrium molecular dynamics. | Q53756273 |
| | The third evolution of ionic liquids: active pharmaceutical ingredients | Q57087187 |
| | Solvent-free electrolytes with aqueous solution-like conductivities | Q57134308 |
| | Effect of tetrabutylphosphonium cation on the physico-chemical properties of amino-acid ionic liquids | Q57623568 |
| | Viscosity of (C2–C14) 1-alkyl-3-methylimidazolium bis(trifluoromethylsulfonyl)amide ionic liquids in an extended temperature range | Q58054832 |
| | Group contribution methods for the prediction of thermophysical and transport properties of ionic liquids | Q58055088 |
| | A group contribution method for viscosity estimation of ionic liquids | Q58055180 |
| P433 | issue | 12 | |
| P407 | language of work or name | English | Q1860 |
| P304 | page(s) | 124507 | |
| P577 | publication date | 2011-09-01 | |
| P1433 | published in | Journal of Chemical Physics | Q900472 |
| P1476 | title | A molecular dynamics investigation of the structural and dynamic properties of the ionic liquid 1-n-butyl-3-methylimidazolium bis(trifluoromethanesulfonyl)imide. | |
| P478 | volume | 135 | |