-
1
-
-
33947237274
-
An overview of spatial microscopic and accelerated kinetic Monte Carlo simulations for materials' simulations
-
A. Chatterjee and D. Vlachos, An overview of spatial microscopic and accelerated kinetic Monte Carlo simulations for materials' simulations, J. Computer-Aided Mater. Design, 14 (2007), p. 253.
-
(2007)
J. Computer-Aided Mater. Design
, vol.14
, pp. 253
-
-
Chatterjee, A.1
Vlachos, D.2
-
2
-
-
0035475511
-
Coarse-grained interactions in polymer melts: A variational approach
-
R. L. C. Akkermans and W. J. Briels, Coarse-grained interactions in polymer melts: A variational approach, J. Chem. Phys., 115 (2001), pp. 6210-6219.
-
(2001)
J. Chem. Phys.
, vol.115
, pp. 6210-6219
-
-
Akkermans, R.L.C.1
Briels, W.J.2
-
3
-
-
0033236867
-
Renormalization-group transformations under strong mixing conditions: Gibbsianness and convergence of renormalized interactions
-
L. Bertini, E. N. M. Cirillo, and E. Olivieri, Renormalization-group transformations under strong mixing conditions: Gibbsianness and convergence of renormalized interactions, J. Stat. Phys., 97 (1999), pp. 831-915.
-
(1999)
J. Stat. Phys.
, vol.97
, pp. 831-915
-
-
Bertini, L.1
Cirillo, E.N.M.2
Olivieri, E.3
-
4
-
-
0001042417
-
Decay of correlations for infinite range interactions in unbounded spin systems
-
C. Cammarota, Decay of correlations for infinite range interactions in unbounded spin systems, Comm. Math. Phys., 85 (1982), pp. 517-528.
-
(1982)
Comm. Math. Phys.
, vol.85
, pp. 517-528
-
-
Cammarota, C.1
-
6
-
-
85128805678
-
The heterogeneous multiscale methods
-
E. Weinan and B. Engquist, The heterogeneous multiscale methods, Commun. Math. Sci., 1 (2003), pp. 87-132.
-
(2003)
Commun. Math. Sci.
, vol.1
, pp. 87-132
-
-
Weinan, E.1
Engquist, B.2
-
7
-
-
0037042149
-
A coarse-graining procedure for flexible polymer chains with bonded and nonbonded interactions
-
H. Fukunaga, J. Takimoto, and M. Doi, A coarse-graining procedure for flexible polymer chains with bonded and nonbonded interactions, J. Chem. Phys., 116 (2002), pp. 8183-8190.
-
(2002)
J. Chem. Phys.
, vol.116
, pp. 8183-8190
-
-
Fukunaga, H.1
Takimoto, J.2
Doi, M.3
-
8
-
-
33749672504
-
Hierarchical modeling of polystyrene: From atomistic to coarse-grained simulations
-
V. A. Harmandaris, N. P. Adhikari, N. F. A. van der Vegt, and K. Kremer., Hierarchical modeling of polystyrene: From atomistic to coarse-grained simulations., Macromolecules, 39 (2006), pp. 6708-6719.
-
(2006)
Macromolecules
, vol.39
, pp. 6708-6719
-
-
Harmandaris, V.A.1
Adhikari, N.P.2
Van Der Vegt, N.F.A.3
Kremer., K.4
-
9
-
-
34948866275
-
Ethylbenzene diffusion in polystyrene: United atom atomistic/coarse grained simulations and experiments
-
V. A. Harmandaris, N. P. Adhikari, N. F. A. van der Vegt, K. Kremer, B. A. Mann, R. Voelkel, H. Weiss, and C. C. Liew, Ethylbenzene diffusion in polystyrene: United atom atomistic/coarse grained simulations and experiments, Macromolecules, 40 (2007), pp. 7026-7035.
-
(2007)
Macromolecules
, vol.40
, pp. 7026-7035
-
-
Harmandaris, V.A.1
Adhikari, N.P.2
Van Der Vegt, N.F.A.3
Kremer, K.4
Mann, B.A.5
Voelkel, R.6
Weiss, H.7
Liew, C.C.8
-
11
-
-
0037456891
-
Coarse-grained stochastic processes and and Monte Carlo simulations in lattice systems
-
M. A. Katsoulakis, A. J. Majda, and D. G. Vlachos, Coarse-grained stochastic processes and and Monte Carlo simulations in lattice systems., J. Comput. Phys., 186 (2003), pp. 250-278.
-
(2003)
J. Comput. Phys.
, vol.186
, pp. 250-278
-
-
Katsoulakis, M.A.1
Majda, A.J.2
Vlachos, D.G.3
-
12
-
-
51749091068
-
Mathematical and statistical methods for the coarse-graining of many particles stochastic systems
-
M. A. Katsoulakis, P. Plecháč, and L. Rey-Bellet, Mathematical and statistical methods for the coarse-graining of many particles stochastic systems, J. Sci. Comput., 37 (2008), pp. 43-71.
-
(2008)
J. Sci. Comput.
, vol.37
, pp. 43-71
-
-
Katsoulakis, M.A.1
Plecháč, P.2
Rey-Bellet, L.3
-
13
-
-
34547938134
-
Coarsegraining schemes and a posteriori error estimates for stochastic lattice systems
-
M. A. Katsoulakis, P. Plecháč, L. Rey-Bellet, and D. K. Tsagkarogiannis, Coarsegraining schemes and a posteriori error estimates for stochastic lattice systems, M2AN Math. Model. Numer. Anal., 41 (2007), pp. 627-660.
-
(2007)
M2AN Math. Model. Numer. Anal.
, vol.41
, pp. 627-660
-
-
Katsoulakis, M.A.1
Plecháč, P.2
Rey-Bellet, L.3
Tsagkarogiannis, D.K.4
-
14
-
-
34547927269
-
Error analysis of coarse-graining for stochastic lattice dynamics
-
M. A. Katsoulakis, P. Plecháč, and A. Sopasakis, Error analysis of coarse-graining for stochastic lattice dynamics, SIAM J. Numer. Anal., 44 (2006), pp. 2270-2296.
-
(2006)
SIAM J. Numer. Anal.
, vol.44
, pp. 2270-2296
-
-
Katsoulakis, M.A.1
Plecháč, P.2
Sopasakis, A.3
-
15
-
-
33644583624
-
Information loss in coarse-graining of stochastic particle dynamics
-
M. A. Katsoulakis and J. Trashorras, Information loss in coarse-graining of stochastic particle dynamics, J. Stat. Phys., 122 (2006), pp. 115-135.
-
(2006)
J. Stat. Phys.
, vol.122
, pp. 115-135
-
-
Katsoulakis, M.A.1
Trashorras, J.2
-
16
-
-
85128858890
-
Equation-free, coarse-grained multiscale computation: Enabling microscopic simulators to perform system-level analysis
-
I. G. Kevrekidis, C. William Gear, J. M. Hyman, P. G. Kevrekidis, O. Runborg, and C. Theodoropoulos, Equation-free, coarse-grained multiscale computation: Enabling microscopic simulators to perform system-level analysis, Commun. Math. Sci., 1 (2003), pp. 715-762.
-
(2003)
Commun. Math. Sci.
, vol.1
, pp. 715-762
-
-
Kevrekidis, I.G.1
William Gear, C.2
Hyman, J.M.3
Kevrekidis, P.G.4
Runborg, O.5
Theodoropoulos, C.6
-
17
-
-
0010523548
-
Multiscale problems in polymer science: Simulation approaches
-
K. Kremer and F. Müller-Plathe, Multiscale problems in polymer science: Simulation approaches, MRS Bull., 26 (2001), p. 205.
-
(2001)
MRS Bull.
, vol.26
, pp. 205
-
-
Kremer, K.1
Müller-Plathe, F.2
-
18
-
-
0037120092
-
Coarse-graining in polymer simulation: From the atomistic to the mesoscale and back
-
F. Müller-Plathe, Coarse-graining in polymer simulation: From the atomistic to the mesoscale and back, Chem. Phys. Chem., 3 (2002), p. 754.
-
(2002)
Chem. Phys. Chem.
, vol.3
, pp. 754
-
-
Müller-Plathe, F.1
-
20
-
-
0000049577
-
Cluster expansion for d-dimensional lattice systems and finite-volume factorization properties
-
E. Olivieri and P. Picco, Cluster expansion for d-dimensional lattice systems and finite-volume factorization properties, J. Stat. Phys., 59 (1990), pp. 221-256.
-
(1990)
J. Stat. Phys.
, vol.59
, pp. 221-256
-
-
Olivieri, E.1
Picco, P.2
-
21
-
-
34547649258
-
Coarse-graining limits in open and wall-bounded dissipative particle dynamics systems
-
I. Pivkin and G. Karniadakis, Coarse-graining limits in open and wall-bounded dissipative particle dynamics systems, J. Chem. Phys., 124 (2006), p. 184101.
-
(2006)
J. Chem. Phys.
, vol.124
, pp. 184101
-
-
Pivkin, I.1
Karniadakis, G.2
-
22
-
-
0035957476
-
Mapping atomistic to coarse-grained polymer models using automatic simplex optimization to fit structural properties
-
D. Reith, H. Meyer, and F. Müller-Plathe, Mapping atomistic to coarse-grained polymer models using automatic simplex optimization to fit structural properties, Macromolecules, 34 (2001), pp. 2335-2345.
-
(2001)
Macromolecules
, vol.34
, pp. 2335-2345
-
-
Reith, D.1
Meyer, H.2
Müller-Plathe, F.3
-
23
-
-
33750281504
-
The solution structure of stilbenoid dendrimers: A small-angle scattering study
-
S. Rosenfeldt, E. Karpuk, M. Lehmann, H. Meier, P. Lindner, L. Harnau, and M. Ballauff, The solution structure of stilbenoid dendrimers: A small-angle scattering study, Chem. Phys. Chem., 7 (2006), p. 2097.
-
(2006)
Chem. Phys. Chem.
, vol.7
, pp. 2097
-
-
Rosenfeldt, S.1
Karpuk, E.2
Lehmann, M.3
Meier, H.4
Lindner, P.5
Harnau, L.6
Ballauff, M.7
-
24
-
-
0032003667
-
Simulation of polymer melts. I. Coarse-graining procedure for polycarbonates
-
W. Tschöp, K. Kremer, O. Hahn, J. Batoulis, and T. J., Bürger, Simulation of polymer melts. I. Coarse-graining procedure for polycarbonates, Acta Polymer., 49 (1998), pp. 61-74.
-
(1998)
Acta Polymer.
, vol.49
, pp. 61-74
-
-
Tschöp, W.1
Kremer, K.2
Hahn, O.3
Batoulis, J.4
Bürger, T.J.5
-
25
-
-
0032002911
-
Simulation of polymer melts. II. from coarse-grained models back to atomistic description
-
W. Tschöp, K. Kremer, O. Hahn, J. Batoulis, and T. J., Bürger., Simulation of polymer melts. II. From coarse-grained models back to atomistic description, Acta Polymer., 49 (1998), pp. 75-79.
-
(1998)
Acta Polymer.
, vol.49
, pp. 75-79
-
-
Tschöp, W.1
Kremer, K.2
Hahn, O.3
Batoulis, J.4
Bürger, T.J.5
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