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Dubravko Sabo
Dubravko Sabo
Geverifieerd e-mailadres voor nyu.edu
Titel
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Jaar
Statistical mechanics: theory and molecular simulation
ME Tuckerman
Oxford university press, 2023
16242023
Free energy calculations
C Chipot, A Pohorille
Springer 86, 159-184, 2007
13692007
Free energy calculations
C Chipot, A Pohorille
Springer 86, 159-184, 2007
13042007
K+/Na+ selectivity in K channels and valinomycin: over-coordination versus cavity-size constraints
S Varma, D Sabo, SB Rempe
Journal of molecular biology 376 (1), 13-22, 2008
1712008
Heat capacity estimators for random series path-integral methods by finite-difference schemes
C Predescu, D Sabo, JD Doll, DL Freeman
The Journal of chemical physics 119 (23), 12119-12128, 2003
692003
Three-dimensional model calculation of torsional levels of (H2O) 3 and (D2O) 3
D Sabo, Z Bačić, T Bürgi, S Leutwyler
Chemical physics letters 244 (3-4), 283-294, 1995
691995
A constant entropy increase model for the selection of parallel tempering ensembles
D Sabo, M Meuwly, DL Freeman, JD Doll
The Journal of chemical physics 128 (17), 2008
542008
Studies of the thermodynamic properties of hydrogen gas in bulk water
D Sabo, S Varma, MG Martin, SB Rempe
The Journal of Physical Chemistry B 112 (3), 867-876, 2008
512008
Phase changes in selected Lennard-Jones X_ {13-n} Y_n clusters
D Sabo, C Predescu, JD Doll, DL Freeman
The journal of chemical physics 121, 856, 2004
442004
Case study of Rb+(aq), quasi-chemical theory of ion hydration, and the no split occupancies rule
D Sabo, D Jiao, S Varma, LR Pratt, SB Rempe
Annual Reports Section" C"(Physical Chemistry) 109, 266-278, 2013
402013
Three-dimensional model treatment of the torsional levels of isotopic water trimers
D Sabo, Z Bačić, S Graf, S Leutwyler
Chemical physics letters 261 (3), 318-328, 1996
361996
Four-dimensional model calculation of torsional levels of cyclic water tetramer
D Sabo, Z Bačić, S Graf, S Leutwyler
The Journal of chemical physics 109 (13), 5404-5419, 1998
321998
Molecular studies of the structural properties of hydrogen gas in bulk water
D Sabo, SB Rempe, JA Greathouse, MG Martin
Molecular Simulation 32 (3-4), 269-278, 2006
282006
Energy estimators for random series path-integral methods
C Predescu, D Sabo, JD Doll, DL Freeman
The Journal of chemical physics 119 (20), 10475-10488, 2003
282003
Numerical implementation of some reweighted path integral methods
C Predescu, D Sabo, JD Doll
The Journal of chemical physics 119 (9), 4641-4654, 2003
282003
Very large amplitude intermolecular vibrations and wave function delocalization in 2,3- van der Waals complex
A Bach, S Leutwyler, D Sabo, Z Bačić
The Journal of chemical physics 107 (21), 8781-8793, 1997
281997
Rotational constants of all H/D substituted water trimers: Coupling of intermolecular torsional and symmetric stretching modes
D Sabo, Z Bačić, S Graf, S Leutwyler
The Journal of chemical physics 110 (12), 5745-5757, 1999
261999
Hydration of Kr (aq) in dilute and concentrated solutions
MI Chaudhari, D Sabo, LR Pratt, SB Rempe
The Journal of Physical Chemistry B 119 (29), 9098-9102, 2015
242015
Calculated and experimental rotational constants of : Effects of intermolecular torsional and symmetric stretching excitations
D Sabo, Z Bačić, S Graf, S Leutwyler
The Journal of chemical physics 111 (12), 5331-5337, 1999
201999
Taming the rugged landscape: Production, reordering, and stabilization of selected cluster inherent structures in the X13− nYn system
D Sabo, JD Doll, DL Freeman
The Journal of chemical physics 121 (2), 847-855, 2004
192004
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Artikelen 1–20