For a complete list of publications, see ResearcherID.

Recent publications:

K. Nygård, S. Sarman and R. Kjellander
"Packing frustration in dense confined fluids"
J. Chem. Phys. 141 (2014) 094501

R. Kjellander
"Electrostatics in Electrolytes Expressed in an Exact Formalism Reminiscent of the Poisson–Boltzmann Picture"
in Electrostatics of Soft and Disordered Matter, Eds: David S. Dean, Jure Dobnikar, Ali Naji, Rudolf Podgornik (Pan Stanford & CRC Press, Boca Raton, USA, 2014), Chapter 5, p. 51-67.

R. Kjellander
"Att konkretisera det abstrakta: Förstå och undervisa om entropi och temperatur" ("To concretize the abstract: Understand and teach about entropy and temperature")
in Modeller, analogier och metaforer i naturvetenskapsundervisning
(Studentlitteratur, Lund, Sweden, 2013) Chapter 3, p. 59-76.

In Swedish

K. Nygård, S. Sarman and R. Kjellander
"Local order variations in confined hard-sphere fluids"
J. Chem. Phys. 139 (2013) 164701

K. Nygård, R. Kjellander, S. Sarman, S. Chodankar, E. Perret, J. Buitenhuis, and J. F. van der Veen
"Anisotropic Pair Correlations and Structure Factors of Confined Hard-Sphere Fluids: An Experimental and Theoretical Study"
Phys. Rev. Letters 108 (2012) 037802

R. H. French, V. A. Parsegian, R. Podgornik, R. F. Rajter, A. Jagota, J. Luo, D. Asthagiri, M. K. Chaudhury, Y-m. Chiang, S. Granick. S. Kalinin, M. Kardar, R. Kjellander, D. C. Langreth, J. Lewis, S. Lustig, D. Wesolowski, J. S. Wettlaufer, W-Y. Ching, M. Finnis, F. Houlihan, O. A. von Lilienfeld. C. J. van Oss and T. Zemb
"Long Range Interactions in Nanoscale Science"
Rev. Mod. Phys., 82 (2010) 1887-1944.

E. Wernersson, R. Kjellander and J. Lyklema
"Charge Inversion and Ion-Ion Correlation Effects at the Mercury/Aqueous MgSO4 Interface: Toward the Solution of a Long-Standing Issue"
J. Phys. Chem. C, 114 (2010) 1849–1866.

R. Kjellander
"Intricate coupling between ion-ion and ion-surface correlations in double layers as illustrated by charge inversion – combined effects of strong Coulomb correlations and excluded volume"
J. Phys.: Condens. Matter 21 (2009) 424101

R. Kjellander and R. Ramirez
"Yukawa multipole electrostatics and non-trivial coupling between electrostatic and dispersion interactions in electrolytes"
J. Phys.: Condens. Matter 20 (2008) 494209.

E. Wernersson and R. Kjellander
“Ion correlation forces between uncharged, dielectric walls”
J. Chem. Phys. 129 (2008) 144701.

E. Wernersson and R. Kjellander
"Image Charges and Dispersion Forces in Electric Double Layers: The Dependence of Wall-Wall Interactions on Salt Concentration and Surface Charge Density"
J. Phys. Chem. B, 111 (2007) 14279 -14284.

K. Lüder, L. Lindfors, J. Westergren, S. Nordholm and R. Kjellander
"In silico prediction of drug solubility: 3. Free Energy of Solvation in Pure Amorphous Matter"
J. Phys. Chem. B, 111 (2007) 7303 -7311.

R. Kjellander
"Fundamental aspects of electrostatic interactions and charge renormalization in electrolyte systems"
Colloid Journal 69 (2007) 20–28.

J. Westergren, L. Lindfors, T. Höglund, K. Lüder, S. Nordholm and R. Kjellander
"In silico prediction of drug solubility: 1. Free energy of hydration"
J. Phys. Chem. B, 111 (2007) 1872 -1882.

K. Lüder, L. Lindfors, J. Westergren, S. Nordholm and R. Kjellander
"In silico prediction of drug solubility: 2. Free energy of solvation in pure melts"
J. Phys. Chem. B, 111 (2007) 1883 -1892.

E. Wernersson and R. Kjellander
“On the effect of image charges and ion-wall dispersion forces on electric double layer interactions”
J. Chem. Phys. 125 (2006) 154702.

R. Ramirez and R. Kjellander
"Effective multipoles and Yukawa electrostatics in dressed molecule theory"
J. Chem. Phys. 125 (2006) 144110

K. Lüder and R. Kjellander
"Towards efficient chemical potential calculations by Expanded Ensemble simulations; to make the free energy pathway fairly level."
J. Phys. Chem. B 110 (2006) 15514 – 15524

R. Kjellander
"Electrostatic screening in classical Coulomb fluids: exponential or power-law decay or both? An investigation into the effect of dispersion interactions."
J. Phys. A: Math. Gen. 39 (2006) 4631 – 4641

R. Kjellander and R. Ramirez
"Screened Coulomb potential and the renormalized charges of ions and molecules in electrolyte solutions."
J. Phys.: Condens. Matter 17 (2005) S3409 – S3421

R. Kjellander and B. Forsberg
"Ionic fluids with 1/rˆ6 pair interactions have power-law electrostatic screening."

J. Phys. A: Math. Gen. 38 (2005) 5405 - 5424

B. Forsberg, J. Ulander and R. Kjellander
"Dressed ion theory of size-asymmetric electrolytes: Effective ionic charges and the decay length of screened Coulomb potential and pair correlations."
J. Chem. Phys. 122 (2005) 064502

R. Ramirez and R. Kjellander
"Dressed molecule theory for liquids and solutions; An exact charge renormalization formalism for molecules with arbitrary charge distributions."
J. Chem. Phys. 119 (2003) 11380 – 11395.

R. Kjellander
"Distribution Function Theory of Electrolytes and Electrical Double Layers: Charge Renormalisation and Dressed Ion Theory"
in Electrostatic Effects in Soft Matter and Biophysics (C. Holm, P. Kékicheff and R Podgornik, Eds; NATO Science Series, Kluwer Academic Publishers, Dordrecht 2001) pp. 317 – 364. (preprint, pdf 11.8 Mb)

J. Ulander, H. Greberg and R. Kjellander
"Primary and Secondary Effective Charges for Electrical Double Layer Systems with Asymmetric Electrolytes"
J. Chem. Phys. 115 (2001) 7144 – 7160

R. Kjellander, A. P. Lyubartsev and S. Marcelja
"McMillan-Mayer Theory for Solvent Effects in Inhomogeneous Systems: Calculation of Interaction Pressure in Aqueous Electrical Double Layers"
J. Chem. Phys. 114 (2001) 9565 – 9577.

J. Ulander and R. Kjellander
"The Decay of Pair Correlation Functions in Ionic Fluids: A Dressed Ion Theory Analysis of Monte Carlo Simulations"
J. Chem. Phys. 114 (2001) 4893 – 4904.

R. Kjellander and H. Greberg
"Mechanisms behind Concentration Profiles Illustrated by Charge and Concentration Distributions around Ions in Double Layers"
J. Electroanalytical Chem. 450 (1998) 233 - 251. (Errata: ibid 462 (1999) 273.)

J. Ulander and R. Kjellander
"Screening and Asymptotic Decay of Pair Distributions in Asymmetric Electrolytes"
J. Chem. Phys. 109 (1998) 9508 - 9522.

H. Greberg, R. Kjellander and T. Åkesson
"Ion-ion Correlations in Electric Double Layers from Monte-Carlo Simulations and Integral Equation Calculations. Part 2, Case of Added Salt"
Mol. Phys. 92 (1997) 35 - 48.

R. Kjellander and D. J. Mitchell
"Dressed Ion Theory for Electric Double Layer Structure and Interactions; An Exact Analysis"
Mol. Phys. 91 (1997) 173 - 188.

Books:

R. Kjellander
"Vad är drivkraften i molekylernas värld? En molekylär introduktion till termodynamik."
Studentlitteratur Förlag, Lund, 2002,
(in Swedish).
Bokens hemsida (description of book, in Swedish).
Recension (review, in Swedish)
.

R. Kjellander
Thermodynamics Kept Simple - A Molecular Approach: "What is the Driving Force in the World of Molecules?"
CRC Press, Boca Raton, USA, 2015
Description of book

Popular science:

R. Kjellander
"Vad är temperatur?" ("What is temperature?")
in Hett om kalla fakta, Vetenskapsrådets temabok 2003

(in Swedish).

Revised: 2015-09-08 Roland Kjellander