Eomxcc: A new Coupled-Cluster Method for Electronic Excited States

Advances in Quantum Chemistry

Volumn 34, Issue C, 1999, Pages 295-380

  Piecuch, Piotr ^a   Bartlett, Rodney J ^a  

^a UNIVERSITY OF FLORIDA   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0002456459     PISSN: 00653276     EISSN: None     Source Type: Book Series    
DOI: 10.1016/S0065-3276(08)60534-1     Document Type: Chapter

References (250)

1. Coester F. Nucl. Phys. 7 (1958) 421
2. Coester F., and Kümmel H. Nucl. Phys. 17 (1960) 477
3. Čížek J. Chem. Phys. 45 (1966) 4256
4. Adv. Chem. Phys. 14 (1969) 35
5. Čížek J., and Paldus J. Int. J. Quantum Chem. 5 (1971) 359
6. Paldus J., Čížek J., and Shavitt I. Phys. Rev. A 5 (1972) 50
7. Bartlett R.J. Ann. Rev. Phys. Chem. 32 (1981) 359
8. J. Phys. Chem. 93 (1989) 1697
9. Bartlett R.J. In: Yarkony D.R. (Ed). Modern Electronic Structure Theory, Part I (1995), World Scientific, Singapore 1047-1131
10. Paldus J. In: Löwdin P.-O., and Pullman B. (Eds). New Horizons of Quantum Chemistry (1983), Reidel, Dordrecht 31-60
11. Bartlett R.J., Dykstra C.E., and Paldus J. In: Dykstra C.E. (Ed). Advanced Theories and Computational Approaches to the Electronic Structure of Molecules (1984), Reidel, Dordrecht 127-159
12. Theoret. Chim. Acta 80 2-6 (1991)
13. Paldus J. In: Wilson S., and Diercksen G.H.F. (Eds). Methods in Computational Molecular Physics, of NATO Advanced Study Institute, Series B: Physics 293 (1992), Plenum, New York 99-194
14. Bartlett R.J., and Stanton J.F. In: Lipkowitz K.B., and Boyd D.B. (Eds). Reviews in Computational Chemistry 5 (1994), VCH Publishers, New York 65-169
15. Lindgren I., and Morrison J. Atomic Many-Body Theory (1982), Springer, Berlin
16. Lindgren I., and Mukherjee D. Phys. Rep. 151 (1987) 93
17. Mukherjee D., and Pal S. Adv. Quantum Chem. 20 (1989) 291
18. Jeziorski B., and Paldus J. J. Chem. Phys. 90 (1989) 2714
19. Coester F. In: Mahanthappa K.T., and Brittin W.E. (Eds). Lectures in Theoretical Physics 11B (1969), Gordon and Breach, New York 157-186
20. Mukherjee D., Moitra R.K., and Mukhopadhyay A. Mol. Phys. 30 (1975) 1861
21. Offerman R., Ey W., and Kümmel H. Nucl. Phys. A 273 (1976) 349
22. Offerman R. Nucl. Phys. A 273 (1976) 368
23. Mukherjee D., Moitra R.K., and Mukhopadhyay A. Mol. Phys. 33 (1977) 955
24. Ey W. Nucl. Phys. A 296 (1978) 189
25. Lindgren I. Int. J. Quantum Chem. Symp. 12 (1978) 33
26. Mukhopadhyay A., Moitra R.K., and Mukherjee D. J. Phys. B 12 (1979) 1
27. Haque A., and Mukherjee D. J. Chem. Phys. 80 (1984) 5058
28. Stolarczyk L., and Monkhorst H.J. Phys. Rev. A 32 (1985) 725-743
29. Haque A., and Kaldor U. Chem. Phys. Lett. 117 (1985) 347
30. Chem. Phys. Lett. 120 (1985) 261
31. Lindgren I. Phys. Scr. 32 (1985) 291-611
32. Sinha D., Mukhopadhyay S.K., Prasad M.D., and Mukherjee D. Chem. Phys. Lett. 125 (1986) 213
33. Sinha D., Mukhopadhyay S., and Mukherjee D. Chem. Phys. Lett. 129 (1986) 369
34. Haque A., and Kaldor U. Int. J. Quantum Chem. 29 (1986) 425
35. Mukherjee D. Chem. Phys. Lett. 125 (1986) 207
36. Kutzelnigg W., Mukherjee D., and Koch S. J. Chem. Phys. 87 (1987) 5902
37. Mukherjee D., Kutzelnigg W., and Koch S. J. Chem. Phys. 87 (1987) 5911
38. Kaldor U. J. Chem. Phys. 87 (1987) 467
39. Pal S., Rittby M., Bartlett R.J., Sinha D., and Mukherjee D. Chem. Phys. Lett. 137 (1987) 273
40. Koch S., and Mukherjee D. Chem. Phys. Lett. 145 (1988) 321
41. Ghose K.B., and Pal S. J. Chem. Phys. 97 (1988) 3863
42. Stolarczyk L., and Monkhorst H.J. Phys. Rev. A 37 (1988) 1908-1926
43. Pal S., Rittby M., Bartlett R.J., Sinha D., and Mukherjee D. J. Chem. Phys. 88 (1988) 4357
44. Chaudhuri R., Sinha D., and Mukherjee D. Chem. Phys. Lett. 163 (1989) 165
45. Kaldor U., Roszak S., Hariharan P.C., and Kaufman J.J. J. Chem. Phys. 90 (1989) 6395
46. Rittby M., Pal S., and Bartlett R.J. J. Chem. Phys. 90 (1989) 3214
47. Pal S., Rittby M., and Bartlett R.J. Chem. Phys. Lett. 160 (1989) 212
48. Watts J.D., Rittby M., and Bartlett R.J. J. Am. Chem. Soc. 111 (1989) 4155
49. Mattie R., Rittby M., Bartlett R.J., and Pal S. Aspects of Many-Body Effects in Molecules and Extended Systems. In: Mukherjee D. (Ed). Lecture Notes in Chemistry 50 (1989), Springer, Berlin 143-153
50. Lindgren I. J. Phys. B 24 (1991) 1143
51. Kaldor U. Chem. Phys. Lett. 166 (1990) 599
52. Chem. Phys. Lett. 170 (1990) 17
53. Theor. Chim. Acta 80 (1991) 427
54. Jankowski K., Paldus J., and Wasilewski J. J. Chem. Phys. 95 (1991) 3549
55. Barysz M., Monkhorst H., and Stolarczyk L.Z. Theor. Chim. Acta 80 (1991) 483
56. Rittby C.M.L., and Bartlett R.J. Theor. Chim. Acta 80 (1991) 469
57. Stanton J.F., Rittby C.M.L., Bartlett R.J., and Toohey D.W. J. Phys. Chem. 95 (1991) 21
58. Stanton J.F., Bartlett R.J., and Rittby C.M.L. J. Chem. Phys. 97 (1992) 5560
59. Barysz M., Rittby M., and Bartlett R.J. Chem. Phys. Lett. 193 (1992) 373
60. Hughes S.R., and Kaldor U. Chem. Phys. Lett. 194 (1992) 99
61. Chem. Phys. Lett. 204 (1993) 339
62. Phys. Rev. A 47 (1993) 4705
63. Vaval N., Ghose K.B., Pal S., and Mukherjee D. Chem. Phys. Lett. 209 (1993) 292
64. Kutzelnigg W. J. Chem. Phys. 77 (1982) 3081
65. Kutzelnigg W., and Koch S. J. Chem. Phys. 79 (1983) 4315
66. Kutzelnigg W. J. Chem. Phys. 80 (1984) 822
67. Pal S., Prasad M.D., and Mukherjee D. Theor. Chim. Acta 62 (1983) 523
68. Theor. Chim. Acta 66 (1984) 311
69. Jankowski K., Paldus J., Grabowski I., and Kowalski K. J. Chem. Phys. 97 (1992) 7600
70. J. Chem. Phys. 101 (1994) 1759 [Erratum]
71. Jankowski K., Paldus J., Grabowski I., and Kowalski K. J. Chem. Phys. 101 (1994) 3085
72. Jeziorski B., and Monkhorst H.J. Phys. Rev. A 24 (1981) 1668
73. Jeziorski B., and Paldus J. J. Chem. Phys. 88 (1988) 5673
74. Paldus J., Pylypow L., and Jeziorski B. Many-Body Methods in Quantum Chemistry. In: Kaldor U. (Ed). Lecture Notes in Chemistry 52 (1989), Springer, Berlin 151-170
75. Piecuch P., and Paldus J. Theor. Chim. Acta 83 (1992) 69
76. Piecuch P., and Paldus J. J. Chem. Phys. 101 (1994) 5875
77. Paldus J., Piecuch P., Jeziorski B., and Pylypow L. In: Ainsworth T.L., Campbell C.E., Clements B.E., and Krotschek E. (Eds). Recent Progress in Many-Body Theories 3 (1992), Plenum, New York 287-303
78. Li X., Piecuch P., and Paldus J. Chem. Phys. Lett. 224 (1994) 267
79. Piecuch P., Li X., and Paldus J. Chem. Phys. Lett. 230 (1994) 377
80. Piecuch P., and Paldus J. J. Phys. Chem. 99 (1995) 15354
81. Paldus J., Piecuch P., Pylypow L., and Jeziorski B. Phys. Rev. A 47 (1993) 2738
82. Piecuch P., ToboŁa R., and Paldus J. Chem. Phys. Lett. 210 (1993) 243
83. Piecuch P., and Paldus J. Phys. Rev. A 49 (1994) 3479
84. Meissner L., Jankowski K., and Wasilewski J. Int. J. Quantum Chem. 34 (1988) 535
85. Meissner L., Kucharski S.A., and Bartlett R.J. J. Chem. Phys. 91 (1989) 6187
86. Meissner L., and Bartlett R.J. J. Chem. Phys. 92 (1990) 561
87. Kucharski S.A., and Bartlett R.J. J. Chem. Phys. 95 (1991) 8227
88. Balková A., Kucharski S.A., Meissner L., and Bartlett R.J. Theor. Chim. Acta 80 (1991) 335
89. Kucharski S.A., and Bartlett R.J. Int. J. Quantum Chem. Symp. 26 (1992) 107
90. Kucharski S.A., Balková A., Szalay P.G., and Bartlett R.J. J. Chem. Phys. 97 (1992) 4289
91. Balková A., Kucharski S.A., and Bartlett R.J. Chem. Phys. Lett. 182 (1991) 511
92. Balková A., Kucharski S.A., Meissner L., and Bartlett R.J. J. Chem. Phys. 95 (1991) 4311
93. Balková A., and Bartlett R.J. Chem. Phys. Lett. 193 (1992) 364
94. J. Chem. Phys. 99 (1993) 7907
95. Szalay P.G., and Bartlett R.J. J. Chem. Phys. 101 (1994) 4936
96. Balková A., and Bartlett R.J. J. Chem. Phys. 101 (1994) 8972
97. J. Chem. Phys. 102 (1995) 7116
98. Berkovic S., and Kaldor U. Chem. Phys. Lett. 199 (1992) 42
99. J. Chem. Phys. 98 (1993) 3090
100. Laidig W.D., and Bartlett R.J. Chem. Phys. Lett. 104 (1984) 424
101. Laidig W.D., Saxe P., and Bartlett R.J. J. Chem. Phys. 86 (1987) 887
102. Harris F.E. Int. J. Quantum Chem. Symp. 11 (1977) 403
103. Banerjee A., and Simons J. Int. J. Quantum Chem. 19 (1981) 207
104. J. Chem. Phys. 76 (1982) 4548
105. Baker H., and Robb M.A. Mol. Phys. 50 (1983) 20
106. Janssen C.L., and Schaefer III H.F. Theor. Chim. Acta 79 (1991) 1
107. Paldus J., and Li X. In: Gruber B. (Ed). Symmetries in science VI (1993), Plenum, New York 573-591
108. Li X., and Paldus J. Int. J. Quantum Chem. Symp. 27 (1993) 269
109. J. Chem. Phys. 101 (1994) 8812
110. Tanaka R., and Terashima H. Chem. Phys. Lett. 106 (1984) 558
111. Hoffman M.R., and Simons J. J. Chem. Phys. 88 (1988) 993
112. Chem. Phys. Lett. 142 (1987) 451
113. Paldus J., Čížek J., Saute M., and Laforgue A. Phys. Rev. A 17 (1978) 805
114. Saute M., Paldus J., and Čížek J. Int. J. Quantum Chem. 15 (1979) 463
115. Nakatsuji H., and Hirao K. Chem. Phys. Lett. 47 (1977) 569
116. J. Chem. Phys. 68 (1978) 2053-4279
117. Nakatsuji H. Chem. Phys. Lett. 59 (1978) 362
118. Chem. Phys. Lett. 67 (1979) 329-334
119. Hirao K., and Nakatsuji H. J. Chem. Phys. 69 (1978) 4535-4548
120. Ohta K., Nakatsuji H., Hirao K., and Yonezawa T. J. Chem. Phys. 73 (1980) 1770
121. Nakatsuji H., and Hirao K. Int. J. Quantum Chem. 20 (1981) 1301
122. Nakatsuji H., Ohta K., and Hirao K. J. Chem. Phys. 75 (1981) 2952
123. Nakatsuji H. Int. J. Quantum Chem. Symp. 17 (1983) 241
124. J. Chem. Phys. 83 (1985) 713
125. Nakatsuji H., Kitao O., and Komori M. Aspects of Many-Body Effects in Molecules and Extended Systems. In: Mukherjee D. (Ed). Lecture Notes in Chemistry 50 (1989), Springer, Berlin 101-122
126. Nakatsuji H. J. Chem. Phys. 95 (1991) 4296
127. Acta Chim. Hung. 129 (1992) 719
128. In: Leszczyński J. (Ed). Computational Chemistry: Reviews of Current Trends 2 (1997), World Scientific, Singapore 62
129. Oliphant N., and Adamowicz L. J. Chem. Phys. 94 (1991) 1229
130. J. Chem. Phys. 96 (1992) 3739
131. Int. Rev. Phys. Chem. 12 (1993) 339
132. Piecuch P., Oliphant N., and Adamowicz L. Int. Rev. Phys. Chem. 99 (1993) 1875
133. Piecuch P., and Adamowicz L. Int. Rev. Phys. Chem. 100 (1994) 5792
134. Chem. Phys. Lett. 221 (1994) 121
135. J. Chem. Phys. 102 (1995) 898
136. Alexandrov V., Piecuch P., and Adamowicz L. J. Chem. Phys. 102 (1995) 3301
137. Ghose K.B., and Adamowicz L. J. Chem. Phys. 103 (1995) 9324
138. Ghose K.B., Piecuch P., and Adamowicz L. J. Chem. Phys. 103 (1995) 9331
139. Ghose K.B., Piecuch P., Pal S., and Adamowicz L. J. Chem. Phys. 104 (1996) 6582
140. Adamowicz L., Piecuch P., and Ghose K.B. Mol. Phys. 94 (1998) 225 P. Piecuch, S.A. Kucharski, and R.J. Bartlett, unpublished.
141. Sekino H., and Bartlett R.J. Int. J. Quantum Chem. Symp. 18 (1984) 255
142. Geertsen J., Rittby M., and Bartlett R.J. Chem. Phys. Lett. 164 (1989) 57
143. Comeau D.C., and Bartlett R.J. Chem. Phys. Lett. 207 (1993) 414
144. Stanton J.F., and Bartlett R.J. J. Chem. Phys. 98 (1993) 7029
145. Emrich K. Nucl. Phys. A 351 (1981) 376
146. Mukherjee D., and Mukherjee P.K. Chem. Phys. 39 (1979) 325
147. Ghosh S., Mukherjee D., and Bhattacharya S.N. Chem. Phys. 72 (1982) 161
148. Mol. Phys. 43 (1981) 173
149. Adman S.S.Z., Bhattacharya S., and Mukherjee D. Chem. Phys. Lett. 85 (1982) 204
150. Ghosh S., and Mukherjee D. Proc. Ind. Acad. Sci. 93 (1984) 947
151. Sinha D., Mukhopadhyay S.K., Prasad M.D., and Mukherjee D. Chem. Phys. Lett. 125 (1986) 213
152. Takahashi M., and Paldus J. J. Chem. Phys. 85 (1986) 1486
153. Monkhorst H. Int. J. Quantum Chem. Symp. 11 (1977) 421
154. Daalgard E., and Monkhorst H. Phys. Rev. A 28 (1983) 1217
155. Nooijen M., and Bartlett R.J. J. Chem. Phys. 102 (1995) 3629
156. Nooijen M., and Bartlett R.J. J. Chem. Phys. 102 (1995) 6735
157. Rowe D.J. Rev. Mod. Phys. 40 (1968) 153
158. McCurdy Jr. C.W., Rescigno T.N., Yeager D.L., and McKoy V. In: Schaefer III H.F. (Ed). Modern Theoretical Chemistry 3 (1977), Plenum, New York 339-386 references therein.
159. Linderberg J., and Öhrn Y. Propagators in Quantum Chemistry (1973), Academic, New York
160. Jørgensen P. Annu. Rev. Phys. Chem. 26 (1975) 359
161. Öhrn Y. In: Pullman B., and Parr R. (Eds). The World of Quantum Chemistry (1976), Reidel, Boston 57
162. Cederbaum L.S., and Domcke W. Adv. Chem. Phys. 36 (1977) 205
163. Oddershede J. Adv. Quantum Chem. 11 (1978) 275
164. Öhrn Y., and Born G. Adv. Quantum Chem. 13 (1981) 1
165. von Niessen W., Schirmer J., and Cederbaum L.S. Comp. Phys. Rep. 1 (1984) 57
166. Oddershede J., Jørgensen P., and Yeager D.L. Comp. Phys. Rep. 2 (1984) 33
167. Oddershede J. Adv. Chem. Phys. 59 (1987) 201
168. Ortiz J.V. In: Leszczyński J. (Ed). Computational Chemistry: Reviews of Current Trends 2 (1997), World Scientific, Singapore 1-61
169. Ortiz J.V., Zakrzewski V.G., and Dolgounitcheva O. In: Calais J.-L., and Kryachko E. (Eds). Conceptual Perspectives in Quantum Chemistry (1997), Kluwer, Dordrecht 465-517
170. Koch H., and Jørgensen P. J. Chem. Phys. 93 (1990) 3333
171. Koch H., Jensen H.J.Aa., Jørgensen P., and Helgaker T. J. Chem. Phys. 93 (1990) 3345
172. Brandow B.H. Rev. Mod. Phys. 39 (1967) 771
173. Meissner L., and Bartlett R.J. J. Chem. Phys. 94 (1991) 6670
174. Mukhopadhyay D., Mukhopadhyay S., Chaudhuri R., and Mukherjee D. Theor. Chim. Acta 80 (1991) 441
175. Meissner L., and Bartlett R.J. J. Chem. Phys. 102 (1995) 7490
176. Watts J.D., and Bartlett R.J. J. Chem. Phys. 101 (1994) 3073
177. Paldus J., Adams B., and Čížek J. Int. J. Quantum Chem. 11 (1977) 813
178. Paldus J. J. Chem. Phys. 67 (1977) 303
179. Adams B.C., and Paldus J. Phys. Rev. A 20 (1979) 1
180. Piecuch P., and Paldus J. Int. J. Quantum Chem. 36 (1989) 429
181. Piecuch P., and Paldus J. Theor. Chim. Acta 78 (1990) 65
182. P. Piecuch R.J. Bartlett unpublished.
183. Rittby M., and Bartlett R.J. J. Phys. Chem. 92 (1988) 3033
184. Sekino H., and Bartlett R.J. Chem. Phys. Lett. 225 (1994) 486
185. Perera S.A., Nooijen M., and Bartlett R.J. J. Chem. Phys. 104 (1996) 3290
186. Stanton J.F., and Bartlett R.J. J. Chem. Phys. 99 (1993) 5178
187. Różyczko P.B., Perera S.A., Nooijen M., and Bartlett R.J. J. Chem. Phys. 107 (1997) 6736
188. Różyczko P.B., and Bartlett R.J. J. Chem. Phys. 107 (1997) 10823
189. Salter E.A., Trucks G.W., and Bartlett R.J. J. Chem. Phys. 90 (1989) 1752
190. Salter E.A., and Bartlett R.J. J. Chem. Phys. 90 (1989) 1767
191. Adamowicz L.A., Laidig W.D., and Bartlett R.J. Int. J. Quantum Chem. Symp. 18 (1984) 245
192. Bartlett R.J. In: Jørgensen P., and Simons J. (Eds). Geometrical Derivatives of Energy Surfaces and Molecular Properties, NATO Advanced Study Institute, Series C: Mathematical and Physical Sciences 166 (1986), Reidel, Dordrecht 35-61
193. Fitzgerald G., Harrison R.J., and Bartlett R.J. J. Chem. Phys. 85 (1986) 5143
194. Scheiner A.C., Scuseria G.E., Rice J.E., Lee T.J., and Schaefer III H.F. J. Chem. Phys. 87 (1987) 5361
195. Koch H., Jensen H.J.Aa., Jørgensen P., Helgaker T., Scuseria G.E., and Schaefer III H.F. J. Chem. Phys. 92 (1990) 4924
196. Kobayashi R., Koch H., and Jørgensen P. J. Chem. Phys. 101 (1994) 4956
197. Kondo A.E., Piecuch P., and Paldus J. J. Chem. Phys. 102 (1995) 6511
198. Gwaltney S.R., and Bartlett R.J. Chem. Phys. Lett. 241 (1995) 26
199. Gwaltney S.R., Nooijen M., and Bartlett R.J. Chem. Phys. Lett. 248 (1996) 189
200. Watts J.D., Gwaltney S.R., and Bartlett R.J. J. Chem. Phys. 105 (1996) 6979
201. Del Bene J.E., Watts J.D., and Bartlett R.J. J. Chem. Phys. 106 (1997) 6051
202. Bartlett R.J., Del Bene J.E., Perera S.A., and Mattie R.P. J. Mel. Struct. (THEOCHEM) 400 (1997) 157
203. Watts J.D., and Bartlett R.J. Chem. Phys. Lett. 233 (1995) 81
204. Watts J.D., and Bartlett R.J. Chem. Phys. Lett. 258 (1996) 581
205. Gutsev G.L., Nooijen M., and Bartlett R.J. Phys. Rev. A 57 (1998) 1646
206. Nooijen M., and Bartlett R.J. J. Chem. Phys. 106 (1997) 6441
207. J. Chem. Phys. 107 (1997) 6812
208. Nooijen M., and Bartlett R.J. J. Chem. Phys. 106 (1997) 6449
209. Thouless D.J. Quantum Mechanics of Many-Body Systems (1961), Academic, New York
210. Bartlett R.J., and Noga J. Chem. Phys. Lett. 150 (1988) 29
211. Bartlett R.J., Kucharski S.A., Noga J., Watts J.D., and Trucks G.W. Many-Body Methods in Quantum Chemistry. In: Kaldor U. (Ed). Lecture Notes in Chemistry 52 (1989), Springer, Berlin 124-150
212. Bartlett R.J., Kucharski S.A., and Noga J. Chem. Phys. Lett. 155 (1989) 133
213. Watts J.D., Trucks G.W., and Bartlett R.J. Chem. Phys. Lett. 157 (1989) 359
214. Kutzelnigg W. In: Schaefer III H.F. (Ed). Modern Theoretical Chemistry 3 (1977), Plenum, New York 129
215. Koch S., and Kutzelnigg W. Theor. Chim. Acta 59 (1981) 387
216. Pal S. Theor. Chim. Acta 66 (1984) 207
217. Szalay P.G., and Bartlett R.J. Int. J. Quantum Chem. Symp. 26 (1992) 85
218. Szalay P.G., Nooijen M., and Bartlett R.J. J. Chem. Phys. 103 (1995) 281
219. Arponen J.S. Ann Phys. 151 (1983) 311
220. Arponen J.S., Bishop R.F., and Pajanne E. Phys. Rev. A 36 (1987) 2519
221. Condensed Matter Theor. 2 (1987) 357
222. Bishop R.F., Arponen J.S., and Pajanne E. Aspects of Many-Body Effects in Molecules and Extended Systems. In: Mukherjee D. (Ed). Lecture Notes in Chemistry 50 (1989), Springer, Berlin 79
223. Bishop R.F., and Arponen J.S. Int. J. Quantum Chem. Symp. 24 (1990) 197
224. Arponen J.S., and Bishop R.F. Ann. Phys. 207 (1991) 171
225. Bishop R.F., Robinson N.I., and Arponen J. Condensed Matter Theor. 5 (1990) 37
226. Bishop R.F. Theor. Chim. Acta 80 (1991) 95
227. Arponen J. Phys. Rev. A 55 (1997) 2686
228. Arponen J.S., Bishop R.F., and Pajanne E. Phys. Rev. A 36 (1987) 2539
229. Löwdin P.-O. J. Math. Phys. 24 (1983) 70
230. Noga J., Kucharski S.A., and Bartlett R.J. J. Chem. Phys. 90 (1989) 3399
231. Kucharski S.A., and Bartlett R.J. Chem. Phys. Lett. 158 (1989) 550
232. Bartlett R.J., Watts J.D., Kucharski S.A., and Noga J. Chem. Phys. Lett. 165 (1990) 513
233. Kucharski S.A., and Bartlett R.J. J. Chem. Phys. 108 (1998) 5243
234. The explicit expressions for hkaij and hjkia in Table 1 of Ref.34 (designated in Ref.34 as Wijka and Wiajk, respectively) are incorrect. If we use the notation of Ref.34, the correct expression for Wiajk hjkia should read: The formula forWijka presented in Ref.34, i.e., should really be regarded as a formula for. Finally, a small change has to be made in expression for. The antisymmetrized two-electron integral ci/mn> in the third term of expression for Wabci has to be replaced by mn/ci> (which is only important if the molecular orbitals are not real). The correct expressions have been used in all calculations [32-34,38,39,46,59-65].
235. Urban M., Noga J., Cole S.J., and Bartlett R.J. J. Chem. Phys. 83 (1985) 4041
236. Cole S.J., and Bartlett R.J. J. Chem. Phys. 86 (1987) 873
237. Piecuch P., ToboŁa R., and Paldus J. Int. J. Quantum Chem. 55 (1995) 133
238. Raghavachari K., Trucks G.W., Pople J.A., and Head-Gordon M. Chem. Phys. Lett. 157 (1989) 479
239. Lee Y.S., and Bartlett R.J. J. Chem. Phys. 80 (1984) 4371
240. Lee Y.S., Kucharski S.A., and Bartlett R.J. J. Chem. Phys. 81 (1984) 5906
241. J. Chem. Phys. 82 (1985) 5761 Erratum
242. Piecuch P., ToboŁa R., and Paldus J. Phys. Rev. A 54 (1996) 1210
243. Paldus J., and Piecuch P. Int. J. Quantum Chem. 42 (1992) 135
244. Kucharski S.A., and Bartlett R.J. J. Chem. Phys. 108 (1998) 5255
245. Jucys A., Levinsonas J., and Vanagas V. Mathematical Apparatus of the Theory of Angular Momentum (1960), Institute of Physics and Mathematics of the Academy of Sciences of the Lithuanian S.S.R., Vilnius [in Russian]; English Translations: Israel Program for Scientific Translations, Jerusalem, 1962; Gordon and Breach, New York, 1964
246. Jucys A., and Bandzaitis A. The Theory of Angular Momentum in Quantum Mechanics. 2nd ed. (1977), Mokslas, Vilnius in Russian
247. Brink D.M., and Satchler G.R. Angular Momentum. 2nd ed. (1968), Clarendon, Oxford
248. El Baz E., and Castel B. Graphical Methods of Spin Algebras in Atomic, Nuclear and Particle Physics (1972), Marcel Dekker, New York For a brief review of these methods, see, e.g., Ref. 10; see, also, Appendices of Ref. 47 and
249. Piecuch P. In: Maruani J. (Ed). Molecules in Physics, Chemistry and Biology, Vol. 2, Physical Aspects of Molecular Systems (1988), Kluwer, Dordrecht 417-505
250. Kucharski S.A., and Bartlett R.J. Theor. Chim. Acta 80 (1991) 387