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Maximilian Kohns
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ms2: A molecular simulation tool for thermodynamic properties, release 3.0
G Rutkai, A Köster, G Guevara-Carrion, T Janzen, M Schappals, ...
Computer Physics Communications 221, 343-351, 2017
832017
Solvent activity in electrolyte solutions from molecular simulation of the osmotic pressure
M Kohns, S Reiser, M Horsch, H Hasse
The Journal of chemical physics 144 (8), 2016
432016
Interfacial and bulk properties of vapor-liquid equilibria in the system toluene+ hydrogen chloride+ carbon dioxide by molecular simulation and density gradient theory+ PC-SAFT
S Werth, M Kohns, K Langenbach, M Heilig, M Horsch, H Hasse
Fluid Phase Equilibria 427, 219-230, 2016
412016
ms2: A molecular simulation tool for thermodynamic properties, release 4.0
R Fingerhut, G Guevara-Carrion, I Nitzke, D Saric, J Marx, K Langenbach, ...
Computer Physics Communications 262, 107860, 2021
402021
Expanding the applications of the SAFT-γ Mie group-contribution equation of state: Prediction of thermodynamic properties and phase behavior of mixtures
AJ Haslam, A González-Pérez, S Di Lecce, SH Khalit, FA Perdomo, ...
Journal of Chemical & Engineering Data 65 (12), 5862-5890, 2020
352020
Dielectric constant and density of aqueous alkali halide solutions by molecular dynamics: A force field assessment
D Saric, M Kohns, J Vrabec
The Journal of Chemical Physics 152 (16), 2020
292020
Thermophysical properties of solutions of iron (III) nitrate-nonahydrate in mixtures of ethanol and water
A Keller, I Wlokas, M Kohns, H Hasse
Journal of Chemical & Engineering Data 65 (7), 3519-3527, 2020
262020
Activities in aqueous solutions of the alkali halide salts from molecular simulation
M Kohns, M Schappals, M Horsch, H Hasse
Journal of Chemical & Engineering Data 61 (12), 4068-4076, 2016
222016
Static and dynamic wetting behavior of drops on impregnated structured walls by molecular dynamics simulation
S Becker, M Kohns, HM Urbassek, M Horsch, H Hasse
The Journal of Physical Chemistry C 121 (23), 12669-12683, 2017
202017
A Force Field for Poly(oxymethylene) Dimethyl Ethers (OMEn)
A Kulkarni, EJ García, A Damone, M Schappals, S Stephan, M Kohns, ...
Journal of Chemical Theory and Computation 16 (4), 2517-2528, 2020
192020
Thermophysical Properties of Mixtures of Titanium(IV) Isopropoxide (TTIP) and p-Xylene
A Keller, I Wlokas, M Kohns, H Hasse
Journal of Chemical & Engineering Data 65 (2), 869-876, 2020
192020
Numerical study of the evaporation and thermal decomposition of a single iron (III) nitrate nonahydrate/ethanol droplet
P Narasu, A Keller, M Kohns, H Hasse, E Gutheil
International Journal of Thermal Sciences 170, 107133, 2021
182021
Activity coefficients from molecular simulations using the OPAS method
M Kohns, M Horsch, H Hasse
The Journal of Chemical Physics 147 (14), 2017
162017
Predictive models for the phase behaviour and solution properties of weak electrolytes: nitric, sulphuric, and carbonic acids
M Kohns, G Lazarou, S Kournopoulos, E Forte, FA Perdomo, G Jackson, ...
Physical Chemistry Chemical Physics 22 (27), 15248-15269, 2020
152020
Relative permittivity of dipolar model fluids from molecular simulation and from the co-oriented fluid functional equation for electrostatic interactions
K Langenbach, M Kohns
Journal of Chemical & Engineering Data 65 (3), 980-986, 2019
142019
Solid-liquid equilibria in mixtures of iron (III) nitrate nonahydrate and ethanol or 1-propanol
A Keller, I Wlokas, M Kohns, H Hasse
Fluid Phase Equilibria 536, 112987, 2021
132021
Thermodynamically rigorous description of the open circuit voltage of redox flow batteries
N Hayer, M Kohns
Journal of The Electrochemical Society 167 (11), 110516, 2020
122020
Thermophysical properties of solutions of iron (III) nitrate nonahydrate in mixtures of 1-propanol and water
A Keller, I Wlokas, M Kohns, H Hasse
Journal of Chemical & Engineering Data 65 (11), 5413-5420, 2020
112020
Molecular simulation study of dielectric constants of pure fluids and mixtures
M Kohns
Fluid Phase Equilibria 506, 112393, 2020
112020
Self‐Diffusion Coefficients in Solutions of Lithium Bis (fluorosulfonyl) imide with Dimethyl Carbonate and Ethylene Carbonate
J Neuhaus, D Bellaire, M Kohns, E von Harbou, H Hasse
Chemie Ingenieur Technik 91 (11), 1633-1639, 2019
112019
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