New Monte Carlo method to compute the free energy of arbitrary solids. Application to the fcc and hcp phases of hard spheres
D FRENKEL, AJC LADD
– Journal of Chemical Physics
(1984)
81,
3188
(DOI: 10.1063/1.448024)
A Monte Carlo simulation study of the two-dimensional melting mechanism
MP ALLEN, D FRENKEL, W GIGNAC, JP MCTAGUE
– The Journal of Chemical Physics
(1983)
78,
4206
(DOI: 10.1063/1.445098)
Monte Carlo Study of the Isotropic-Nematic Transition in a Fluid of Thin Hard Disks
D FRENKEL, R EPPENGA
– Physical Review Letters
(1982)
49,
1089
(DOI: 10.1103/physrevlett.49.1089)
Molecular Dynamics Study of Infinitely Thin Hard Rods: Scaling Behavior of Transport Properties
D FRENKEL, JF MAGUIRE
– Physical Review Letters
(1981)
47,
1025
(DOI: 10.1103/physrevlett.47.1025)
Computer Simulations of Freezing and Supercooled Liquids
D FRENKEL, JP MCTAGUE
– Annual Review of Physical Chemistry
(1980)
31,
491
Molecular dynamics studies of orientational and collision-induced light scattering in molecular fluids
D FRENKEL, JP MCTAGUE
– Journal of Chemical Physics
(1980)
72,
2801
(DOI: 10.1063/1.439429)
Evidence for an orientationally ordered two-dimensional fluid phase from molecular-dynamics calculations
D FRENKEL, JP MCTAGUE
– Physical Review Letters
(1979)
42,
1632
(DOI: 10.1103/PhysRevLett.42.1632)
MOLECULAR-DYNAMICS TEST OF THE HALPERIN-NELSON 2-DIMENSIONAL MELTING THEORY
D FRENKEL, JP MCTAGUE
– BULLETIN OF THE AMERICAN PHYSICAL SOCIETY
(1979)
24,
362
On the Raman spectrum of argon dimersa)
D FRENKEL, JP MCTAGUE
– Journal of Chemical Physics
(1979)
70,
2695
(DOI: 10.1063/1.437855)
Experimental and calculated cross sections for pressure broadening of pure rotational Raman lines of HCl
GJQ VANDERPEIJL, D FRENKEL, J VANDERELSKEN
– Chemical Physics Letters
(1978)
56,
602
(DOI: 10.1016/0009-2614(78)89050-2)
Determination of potential energy surfaces for Ar–HCl and Kr–HCl from rotational linebroadening data
JG KIRCZ, GJQ VANDERPEYL, J VANDERELSKEN, D FRENKEL
– Journal of Chemical Physics
(1978)
69,
4606
(DOI: 10.1063/1.436412)
Rotational relaxation of solute molecules in dense noble gases and the relation with local anisotropy fluctuations
J Van Der Elsken, D Frenkel
– Faraday Symposia of the Chemical Society
(1977)
11,
125
(DOI: 10.1039/fs9771100125)
Density dependence of the pressure induced shift of HCl rotational lines perturbed by argon
D FRENKEL, J VANDERELSKEN
– Chemical Physics Letters
(1977)
50,
116
(DOI: 10.1016/0009-2614(77)80692-1)
A far infrared study of the Ar–HCl van der Waals molecule
EW BOOM, D FRENKEL, J VANDERELSKEN
– The Journal of Chemical Physics
(1977)
66,
1826
(DOI: 10.1063/1.434201)
Anisotropic density fluctuations in argon at different densities: Far infrared measurements and molecular dynamic calculations
D FRENKEL, J VANDERELSKEN
– Journal of Chemical Physics
(1977)
67,
4243
(DOI: 10.1063/1.435406)
General discussion
AD Buckingham, A Gerschel, G Wyllie, W Alexiewicz, J Buchert, S Kielich, G Williams, J Yarwood, JS Rowlinson, BJ Berne, D Frenkel, T Dorfmüller, G Searby, M Davies, JM Vaughan, R Pecora, D Kivelson, PSY Cheung, PA Madden, RM Lynden-Bell, MR Battaglia, TI Cox, RA Shatwell, GC Tabisz, DW Oxtoby, K Singer
– Faraday Symp. Chem. Soc.
(1977)
11,
148
(DOI: 10.1039/FS9771100148)
Molecular dynamics calculations on the time dependence of simple, anisotropic potentials in dense argon
D FRENKEL, J VANDERELSKEN
– Chemical Physics Letters
(1976)
40,
14
(DOI: 10.1016/0009-2614(76)80109-1)
Non-linear density dependence of rotational line-broadening of HCl in dense argon
D FRENKEL, DJ GRAVESTEYN, J VANDERELSKEN
– Chemical Physics Letters
(1976)
40,
9
(DOI: 10.1016/0009-2614(76)80108-X)
A far infrared study of the Ar-HCI van der Waals molecule
EW Boom, D Frenkel, J Van Der Elsken
– Journal of Chemical Physics
(1976)
66,
1826
(DOI: 10.1063/1.434201)
Rotational diffusion model with a variable collision distribution. II. The effect of energy transfer
D FRENKEL, GH WEGDAM
– The Journal of Chemical Physics
(1974)
61,
4671
(DOI: 10.1063/1.1681789)