Citation: J. Kolafa et M. Ratner, OLIGOMERS OF POLY(ETHYLENE OXIDE) - MOLECULAR-DYNAMICS WITH A POLARIZABLE FORCE-FIELD, Molecular simulation (Print), 21(1), 1998, pp. 1-26
Citation: J. Kolafa et al., GLOBAL PHASE-DIAGRAMS OF MODEL AND REAL BINARY-FLUID MIXTURES - LORENTZ-BERTHELOT MIXTURE OF ATTRACTIVE HARD-SPHERES, Fluid phase equilibria, 146(1-2), 1998, pp. 103-121
Citation: I. Nezbeda et al., GLOBAL PHASE-DIAGRAMS OF BINARY-MIXTURES - SYSTEMATIC BASIS FOR DESCRIBING TYPES OF PHASE-EQUILIBRIUM PHENOMENA, Journal of the Chemical Society. Faraday transactions, 93(17), 1997, pp. 3073-3080
Citation: I. Nezbeda et al., MOLECULAR THEORY OF PHASE-EQUILIBRIA IN MODEL AND REAL ASSOCIATED MIXTURES .3. BINARY-SOLUTIONS OF INERT-GASES AND N-ALKANES IN AMMONIA ANDMETHANOL, Fluid phase equilibria, 130(1-2), 1997, pp. 133-156
Citation: J. Kolafa, NUMERICAL-INTEGRATION OF EQUATIONS OF MOTION WITH A SELF-CONSISTENT-FIELD GIVEN BY AN IMPLICIT EQUATION, Molecular simulation, 18(3), 1996, pp. 193-212
Authors:
BAEKDAL L
JOOSEN W
LARSEN T
KOLAFA J
OVESEN JH
PERRAM JW
PETERSEN HG
BYWATER R
RATNER M
Citation: L. Baekdal et al., THE OBJECT-ORIENTED DEVELOPMENT OF A PARALLEL APPLICATION IN PROTEIN DYNAMICS - WHY WE NEED SOFTWARE TOOLS FOR HPCN APPLICATIONS, Computer physics communications, 97(1-2), 1996, pp. 124-135
Citation: I. Nezbeda et J. Kolafa, THE USE OF CONTROL QUANTITIES IN COMPUTER-SIMULATION EXPERIMENTS - APPLICATION TO THE EXP-6 POTENTIAL FLUID, Molecular simulation, 14(3), 1995, pp. 153-163
Citation: I. Nezbeda et al., MOLECULAR THEORY OF PHASE-EQUILIBRIA IN MODEL AND REAL ASSOCIATED MIXTURES .2. BINARY AQUEOUS MIXTURES OF INERT-GASES AND N-ALKANES, The Journal of chemical physics, 102(24), 1995, pp. 9638-9646
Authors:
SOLVASON D
KOLAFA J
PETERSEN HG
PERRAM JW
Citation: D. Solvason et al., A RIGOROUS COMPARISON OF THE EWALD METHOD AND THE FAST MULTIPOLE METHOD IN 2 DIMENSIONS, Computer physics communications, 87(3), 1995, pp. 307-318
Citation: J. Kolafa et I. Nezbeda, THE LENNARD-JONES FLUID - AN ACCURATE ANALYTIC AND THEORETICALLY-BASED EQUATION OF STATE, Fluid phase equilibria, 100, 1994, pp. 1-34
Citation: I. Nezbeda et al., MOLECULAR THEORY OF PHASE-EQUILIBRIA IN MODEL ASSOCIATED MIXTURES .1.BINARY-MIXTURES OF WATER AND A SIMPLE FLUID, The Journal of chemical physics, 100(3), 1994, pp. 2191-2201
Citation: K. Aim et al., THE LENNARD-JONES FLUID REVISITED - NEW THERMODYNAMIC DATA AND NEW EQUATION OF STATE, Fluid phase equilibria, 83, 1993, pp. 15-22
Authors:
PAYNE VA
FORSYTH M
KOLAFA J
RATNER MA
DELEEUW SW
Citation: Va. Payne et al., DIPOLE TIME-CORRELATION FUNCTIONS OF THE STOCKMAYER FLUID IN THE MICROCANONICAL AND CANONICAL ENSEMBLES, Journal of physical chemistry, 97(40), 1993, pp. 10478-10485