SCOPUS 정보 검색 플랫폼

Journal of Chemical Physics

Volumn 116, Issue 19, 2002, Pages 8262-8269

Torsional path integral Monte Carlo method for the quantum simulation of large molecules

(2) Miller, Thomas F a Clary, David C a

a UNIVERSITY COLLEGE LONDON (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

BUTANE; CONSTRAINT THEORY; DEGREES OF FREEDOM (MECHANICS); ETHANE; INTEGRAL EQUATIONS; KINETIC ENERGY; MACROMOLECULES; MATHEMATICAL OPERATORS; MATHEMATICAL TRANSFORMATIONS; MONTE CARLO METHODS; POISSON DISTRIBUTION; POLYCRYSTALLINE MATERIALS; POLYETHYLENES; PROTEINS; RAPID THERMAL ANNEALING; TORSION TESTING;

INTERMOLECULAR MOTIONS; TORSIONAL PATH INTEGRAL MONTE CARLO (TPIMC) METHODS;

QUANTUM THEORY;

EID: 0037088367 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.1467342 Document Type: Article

Times cited : (34)

References (43)

1
- 36749115948
- (1979) J. Chem. Phys , vol.70 , pp. 2914
- Barker, J.A.¹

2
- 33645931176
- (1981) J. Chem. Phys , vol.74 , pp. 4078
- Chandler, D.¹ Wolynes, R.G.²

3
- 0000797345
- (1986) Annu. Rev. Phys. Chem , vol.37 , pp. 401
- Berne, B.J.¹ Thirumalai, D.²

4
- 0011117492
- World Scientific, Singapore
- (1990) Quantum Simulations of Condensed Matter Phenomena
- Berne, B.J.¹ Thirumalai, D.²

5
- 0003625787
- Elsevier, Amsterdam
- (1991) Liquids, Freezing and Glass Transition
- Chandler, D.¹

6
- 36549091112
- (1980) J. Chem. Phys , vol.80 , pp. 2239
- Doll, J.D.¹ Freeman, D.L.²

7
- 0001084409
- (1984) J. Phys. Chem , vol.88 , pp. 3400
- Chandler, D.¹

8
- 4243346405
- (1986) Phys. Rev. Lett , vol.55 , pp. 1
- Doll, J.D.¹ Coalson, R.D.² Freeman, D.L.³

9
- 36749113949
- (1979) J. Chem. Phys , vol.71 , pp. 2880
- Doll, J.D.¹ Meyers, L.E.²

10
- 0001615495
- (1992) Phys. Rev. Lett , vol.69 , pp. 3527
- Runge, K.J.¹ Surh, M.P.² Mailhiot, C.³ Pollock, E.L.⁴

11
- 0002304341
- (2000) J. Phys. Chem. A , vol.104 , pp. 86
- Lee, Y.H.¹ Berne, B.J.²

12
- 0035134004
- (2001) J. Phys. Chem. A , vol.105 , pp. 459
- Lee, Y.H.¹ Berne, B.J.²

13
- 0033215627
- (1999) Phys. Rev. E , vol.60 , pp. 4652
- Dewey, T.G.¹

14
- 0000533027
- (1999) J. Phys.: Condens. Matter , vol.11 , pp. R117
- Marx, D.¹ Muser, M.H.²

15
- 0000329040
- (1992) Phys. Rev. A , vol.45 , pp. 8968
- Marx, D.¹ Nielaba, P.²

16
- 0001615495
- (1992) Phys. Rev. Lett , vol.69 , pp. 3527
- Runge, K.J.¹ Surh, M.P.² Mailhiot, C.³ Pollock, E.L.⁴

17
- 0001440371
- (2000) J. Chem. Phys , vol.112 , pp. 8758
- Mielke, S.L.¹ Srinivasan, J.² Truhlar, D.G.³

18
- 0035128145
- (2001) J. Chem. Phys , vol.114 , pp. 621
- Mielke, S.L.¹ Truhlar, D.G.²

19
- 0035827810
- (2001) J. Chem. Phys , vol.115 , pp. 652
- Mielke, S.L.¹ Truhlar, D.G.²

20
- 0001243321
- (1998) J. Chem. Phys , vol.108 , pp. 10274
- Rutledge, G.C.¹ Lacks, D.J.² Martoňák, R.³ Binder, K.⁴

21
- 0000225467
- (1998) Phys. Rev. E , vol.57 , pp. 2425
- Martoňák, R.¹ Paul, W.² Binder, K.³

22
- 0035827121
- (2001) J. Chem. Phys , vol.114 , pp. 9725
- Clary, D.C.¹

23
- 0009305283
- (1994) Phys. Rev. E , vol.49 , pp. 882
- Cao, J.¹

24
- 0003495236
- McGraw-Hill, New York
- (1965) Quantum Mechanics and Path Integrals
- Feynman, R.P.¹ Hibbs, A.R.²

25
- 0003575440
- Benjamin, Reading, MA
- (1972) Statistical Mechanics
- Feynman, R.P.¹

26
- 0003644102
- Wiley, New York
- (1981) Techniques and Applications of Path Integrations
- Schulman, L.S.¹

27
- 4243506670
- (1970) Phys. Rev. A , vol.2 , pp. 250
- Kalos, M.H.¹

28
- 33847547289
- (1974) Phys. Rev. A , vol.9 , pp. 2178
- Kalos, M.H.¹ Levesque, D.² Verlet, L.³

29
- 49249146246
- (1979) J. Comput. Phys , vol.30 , pp. 361
- Whitlock, P.A.¹ Kalos, M.H.²

30
- 2842556347
- Springer, Berlin
- (1981) Monte Carlo Methods in Statistical Physics
- Ceperley, D.M.¹ Kalos, M.H.²

31
- 0001064590
- (1976) Commun. Math. Phys , vol.56 , pp. 183
- Suzuki, M.¹

32
- 0003517424
- Springer, Berlin
- (1987) Quantum Monte Carlo Methods in Equilibrium and Nonequilibrium Systems
- Suzuki, M.¹

33
- 84968520470
- (1959) Proc. Am. Math. Soc , vol.10 , pp. 545
- Trotter, H.F.¹

34
- 0004048494
- World Scientific, Singapore
- (1990) Path Integrals in Quantum Mechanics, Statistics and Polymer Physics
- Kleinert, H.¹

35
- 0000181146
- (1998) J. Chem. Phys , vol.109 , pp. 2279
- Vivier-Bunge, A.¹ Uc, V.H.² Smeyers, Y.G.³

36
- 0004125325
- Holt, Rinehart, and Winston, New York
- (1961) A Brief Introduction to Theta Functions
- Bellman, R.¹

37
- 0009161450
- (1955) Nuevo Cimento , vol.2 , pp. 197
- Burton, W.K.¹ De Borde, A.H.²

38
- 36749119321
- (1982) J. Chem. Phys , vol.76 , pp. 5150
- Herman, M.F.¹ Bruskin, E.J.² Berne, B.J.³

39
- 0024821263
- (1989) J. Am. Chem. Soc , vol.111 , pp. 8551
- Allinger, N.L.¹ Yuh, Y.H.² Li, J.H.³

40
- 0003684555
- (2000) TINKER Software Tools for Molecular Design, Version 3.8
- Ponder, J.W.¹

41
- 0000435162
- (1980) Math. Comput , vol.35 , pp. 773
- Nocedal, J.¹

42
- 5744249209
- (1953) J. Chem. Phys , vol.21 , pp. 1087
- Metropolis, N.¹ Rosenbluth, A.W.² Rosenbluth, M.N.³ Teller, A.H.⁴ Teller, E.⁵

43
- 0003570366
- Addison-Wesley, New York
- (1994) Modern Quantum Mechanics
- Sakurai, J.J.¹

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.