SCOPUS 정보 검색 플랫폼 - 논문 보기

메뉴 건너뛰기

Computer Physics Communications

Volumn 143, Issue 3, 2002, Pages 222-240

Numerical solving of the vibrational time-independent Schrödinger equation in one and two dimensions using the variational method

(2) Stare, Jernej a Mavri, Janez a

a NATIONAL INSTITUTE OF CHEMISTRY (Slovenia)

Author keywords

Gaussian basis set; Hydrogen bond; Rectangular basis set; Schr dinger equation; Variational method; Vibrational spectroscopy

Indexed keywords

COMPUTATIONAL METHODS; COMPUTER SOFTWARE; HYDROGEN BONDS; MOLECULAR STRUCTURE; SET THEORY; VARIATIONAL TECHNIQUES;

SCHRODINGER EQUATIONS; VIBRATIONAL SPECTROSCOPY;

WAVE EQUATIONS;

EID: 0036498491 PISSN: 00104655 EISSN: None Source Type: Journal
DOI: 10.1016/S0010-4655(01)00457-X Document Type: Article

Times cited : (65)

References (57)

1
- 0001183787
- (1996) Science , vol.271 , pp. 1563-1566
- Gertner, B.J.¹ Hynes, J.T.²

2
- 0000991264
- (1999) J. Phys. Chem. A , vol.103 , pp. 10398-10408
- Ando, K.¹ Hynes, J.T.²

3
- 0033264221
- (1999) Israel J. Chem. , vol.39 , pp. 469-482
- Zahn, D.¹ Brickman, J.²

4
- 0029209256
- (1995) J. Mol. Liquids , vol.63 , pp. 89
- Azzouz, H.¹ Borgis, D.²

5
- 0000609352
- (1999) J. Phys. Chem. A , vol.103 , pp. 2891-2898
- Decornez, H.¹ Drukker, K.² Hammes-Schiffer, S.³

6
- 0000473772
- (1995) J. Phys. Chem. , vol.99 , pp. 12711-12717
- Mavri, J.¹ Berendsen, H.J.C.²

7
- 0032546691
- (1998) Chem. Phys. Lett. , vol.289 , pp. 457-462
- Fedorowitz, A.¹ Mavri, J.² Bala, P.³ Koll, A.⁴

8
- 0031337237
- (1997) Comput. Phys. Comm. , vol.107 , pp. 61-91
- Billeter, S.¹ Van Gunsteren, W.²

9
- 0033751528
- (2000) J. Phys. Chem. A , vol.104 , pp. 3276-3286
- Billeter, S.¹ Van Gunsteren, W.²

10
- 41549146022
- (1993) J. Mol. Struct. , vol.283 , pp. 57-62
- Jaroszewski, L.¹ Lesying, B.² McCammon, J.A.³

11
- 0000629673
- (1989) J. Phys. Chem. , vol.93 , pp. 220-225
- Tachibana, A.¹ Inoue, T.² Nagaoka, M.³ Yamabe, T.⁴

12
- 0030580019
- (1996) Chem. Phys. Lett. , vol.261 , pp. 35-44
- Klopper, W.¹ Quack, M.² Suhm, M.A.³

13
- 0032804830
- (1999) Chem. Eur. J. , vol.5 , pp. 3581-3594
- Guerra, C.F.¹ Bickelhaupt, F.M.² Snijders, J.G.³ Baerends, E.J.⁴

14
- 0000880812
- (1990) Chem. Phys. Lett. , vol.175 , pp. 282-288
- Jaroszewski, L.¹ Lesyng, B.²

15
- 0000464953
- (1996) J. Phys. Chem. , vol.100 , pp. 15388-15392
- Bueker, H.-H.¹ Helgaker, T.² Ruud, K.³ Uggerud, E.⁴

16
- 0001566218
- (2000) J. Phys. Chem. A , vol.104 , pp. 1004-1008
- Abkowicz-Bienko, A.J.¹ Latajka, Z.²

17
- 0001244892
- (2000) J. Comp. Chem. , vol.21 , pp. 257-269
- Fores, M.¹ Duran, M.² Sola, M.³ Adamowicz, L.⁴

18
- 0000196666
- (1986) Chem. Phys. , vol.109 , pp. 207-213
- Mijoule, C.¹ Allavena, M.² Leclercq, J.M.³ Bouteiller, Y.⁴

19
- 0000503276
- (1999) Int. Rev. Phys. Chem. , vol.18 , pp. 119-162
- Bene, J.E.D.¹ Jordan, M.J.T.²

20
- 0000990634
- (1999) Int. Rev. Phys. Chem. , vol.18 , pp. 301-341
- Laane, J.¹

21
- 0000438818
- (1995) J. Phys. Chem. , vol.99 , pp. 12220-12224
- Geppert, S.¹ Rabold, A.² Zundel, G.³

22
- 4043150532
- (1992) J. Chem. Phys. , vol.97 , pp. 145-149
- Bouteiller, Y.¹ Latajka, Z.²

23
- 0001228609
- (1989) J. Comp. Phys. , vol.82 , pp. 147-160
- Eckert, M.¹

24
- 0034732294
- (2000) J. Phys. Chem. A , vol.104 , pp. 2772-2779
- Chaban, G.M.¹ Jung, J.O.² Gerber, R.B.³

25
- 0001174761
- (1998) J. Chem. Phys. , vol.108 , pp. 9685-9693
- Alexandrov, V.¹ Smith, D.M.A.² Rostkowska, H.³ Nowak, M.J.⁴ Adamowicz, L.⁵ McCharty, W.⁶

26
- 5644223704
- (1992) Int. Rev. Phys. Chem. , vol.11 , pp. 317-344
- Balint-Kurti, G.G.¹ Dixon, R.N.² Marston, C.C.³

27
- 26844506572
- (1989) J. Chem. Phys. , vol.91 , pp. 3571-3576
- Marston, C.C.¹ Balint-Kurti, G.G.²

28
- 0002580564
- (1972) Chem. Phys. Lett. , vol.17 , pp. 49-52
- Almlöf, J.¹

29
- 0001557769
- (1999) J. Chem. Phys. , vol.111 , pp. 2565-2587
- Kuhn, B.¹ Rizzo, T.R.² Luckhaus, D.³ Quack, M.⁴ Suhm, M.A.⁵

30
- 0342936427
- (2001) J. Chem. Phys. , vol.114 , pp. 240-249
- Vener, M.V.¹ Kühn, O.² Sauer, J.³

31
- 0000484910
- (1998) Ber. Bunsenges. Phys. Chem. , vol.102 , pp. 292-297
- Doslić, N.¹ Kühn, O.² Manz, J.³

32
- 0000130898
- (1998) J. Phys. Chem. A , vol.102 , pp. 9645-9650
- Doslić, N.¹ Kühn, O.² Manz, J.³ Sunderman, K.⁴

33
- 0033559435
- (1999) Phys. Chem. Chem. Phys. , vol.1 , pp. 1249-1257
- Doslić, N.¹ Sunderman, K.² Gonzalez, L.³ Mo, O.⁴ Kühn, O.⁵

34
- 0035400155
- (2001) Chem. Phys. , vol.269 , pp. 59-73
- Doslić, N.¹ Stare, J.² Mavri, J.³

35
- 0035869083
- (2001) J. Phys. Chem. A , vol.105 , pp. 2039-2044
- Mavri, J.¹ Grdadolnik, J.²

36
- 0035868968
- (2001) J. Phys. Chem. A , vol.105 , pp. 2045-2051
- Mavri, J.¹ Grdadolnik, J.²

37
- 0002479397
- (1999) Int. Rev. Phys. Chem. , vol.18 , pp. 5-41
- Siebrand, W.¹ Smedarchina, Z.² Zgierski, M.Z.³ Fernández-Ramos, A.⁴

38
- 0033718746
- (2000) J. Phys. Chem. A , vol.104 , pp. 5898-5909
- Scheiner, S.¹

39
- 0034718623
- (2000) J. Mol. Struct. , vol.552 , pp. 63-70
- Ichikawa, M.¹

40
- 0003842251
- Wiley
- (1997) Theoretical Treatments of Hydrogen Bonding
- Hadži, D.¹

41
- 0000922889
- (2000) Phys. Rev. E , vol.61 , pp. 5211-5217
- Bratos, S.¹ Gale, G.M.² Gallot, G.³ Hache, F.⁴ Lascoux, N.⁵ Leickman, J.C.⁶

42
- 0033636381
- (2000) Phys. Reports , vol.324 , pp. 1-105
- Beck, M.H.¹ Jäckle, A.² Worth, G.A.³ Meyer, H.-D.⁴

43
- 0031561597
- (1997) Chem. Phys. Lett. , vol.264 , pp. 429-434
- Vener, M.V.¹ Sokolov, N.D.²

44
- 36749108304
- (1975) J. Chem. Phys. , vol.63 , pp. 1499-1503
- Anderson, J.B.¹

45
- 0034271901
- (2000) J. Phys. Chem. A , vol.104 , pp. 8540-8545
- Makarov, D.E.¹ Metiu, H.²

46
- 0003468774
- MacMillan
- (1982) Modern Qunatum Chemistry
- Szabo, A.¹ Ostlund, N.S.²

47
- 0001565601
- (1971) J. Phys. Chem. , vol.75 , pp. 1756
- Locker, D.J.¹

48
- 0001486146
- (1973) J. Chem. Phys. , vol.59 , pp. 6450
- Shore, B.W.¹

49
- 0003461132
- John Wiley and Sons, New York
- (1991) Computer Modelling of Chemical Reactions in Enzymes and Solutions
- Warshel, A.¹

50
- 0004161838
- Cambridge University Press
- (1992) Numerical Recipes
- Press, W.H.¹ Teukolsky, S.A.² Vetterling, W.T.³ Flannery, B.P.⁴

51
- 0003653882
- Department of Computer Science, Dartmouth College, Hanover, NH, 03755
- GNUPLOT: A command driven interactive function plotting program
- Williams, T.¹ Kelley, C.²

52
- 0000094293
- (2000) Acta Cryst. C , vol.56 , pp. 577-579
- Steiner, T.¹ Schreurs, A.M.M.² Lutz, M.³ Kroon, J.⁴

53
- 0034599642
- (2000) J. Mol. Struct. (THEOCHEM) , vol.500 , pp. 429-440
- Stare, J.¹ Mavri, J.² Ambrožič, G.³ Hadži, D.⁴

54
- 0002491684
- (1981) Org. Magn. Reson. , vol.15 , pp. 78-82
- Brzezinski, B.¹ Szafran, M.²

55

56
- 0000327386
- (1939) Proc. Roy. Soc. A , vol.170 , pp. 222-241
- Robertson, J.M.¹ Ubbelohde, A.R.²

57
- 0035922555
- (2001) J. Phys. Chem. A , vol.105 , pp. 8465-8487
- Albu, T.V.¹ Corchado, J.C.² Truhlar, D.G.³

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.