SCOPUS 정보 검색 플랫폼

Volumn 101, Issue 25, 2008, Pages

Parametrization of the two-electron reduced density matrix for its direct calculation without the many-electron wave function

(1) Mazziotti, David A a

a UNIVERSITY OF CHICAGO (United States)

Author keywords

[No Author keywords available]

Indexed keywords

FUNCTIONS;

AB INITIO; BOND DISTANCES; COMPUTATIONAL COSTS; DENSITY MATRIXES; DIRECT CALCULATIONS; ELECTRON WAVE FUNCTIONS; HARMONIC FREQUENCIES; HIGHLY EFFICIENT; NON EQUILIBRIUMS; PARAMETRIZATION; STATE ENERGIES;

QUANTUM THEORY;

EID: 57949085898 PISSN: 00319007 EISSN: 10797114 Source Type: Journal
DOI: 10.1103/PhysRevLett.101.253002 Document Type: Article

Times cited : (82)

References (18)

1
- 33846525684
- edited by D.A. Mazziotti, Advances in Chemical Physics Vol. Wiley, New York
- Two-Electron Reduced-Density-Matrix Mechanics, edited by, D.A. Mazziotti, Advances in Chemical Physics Vol. 134 (Wiley, New York, 2007).
- (2007) Two-Electron Reduced-Density-Matrix Mechanics , vol.134

2
- 0003427924
- Springer, New York
- A.J. Coleman and V.I. Yukalov, Reduced Density Matrices: Coulson's Challenge (Springer, New York, 2000).
- (2000) Reduced Density Matrices: Coulson's Challenge
- Coleman, A.J.¹ Yukalov, V.I.²

3
- 4243998216
- PLRAAN 1050-2947 10.1103/PhysRevA.17.1257
- J.E. Harriman, Phys. Rev. A 17, 1257 (1978). PLRAAN 1050-2947 10.1103/PhysRevA.17.1257
- (1978) Phys. Rev. A , vol.17 , pp. 1257
- Harriman, J.E.¹

4
- 84987142350
- IJQCB2 0020-7608 10.1002/qua.560130603
- R.M. Erdahl, Int. J. Quantum Chem. 13, 697 (1978). IJQCB2 0020-7608 10.1002/qua.560130603
- (1978) Int. J. Quantum Chem. , vol.13 , pp. 697
- Erdahl, R.M.¹

5
- 37649028080
- PRLTAO 0031-9007 10.1103/PhysRevLett.93.213001
- D.A. Mazziotti, Phys. Rev. Lett. 93, 213001 (2004). PRLTAO 0031-9007 10.1103/PhysRevLett.93.213001
- (2004) Phys. Rev. Lett. , vol.93 , pp. 213001
- Mazziotti, D.A.¹

6
- 1442282174
- JCPSA6 0021-9606 10.1063/1.1636721
- Z. Zhao, B.J. Braams, H. Fukuda, M.L. Overton, and J.K. Percus, J. Chem. Phys. 120, 2095 (2004). JCPSA6 0021-9606 10.1063/1.1636721
- (2004) J. Chem. Phys. , vol.120 , pp. 2095
- Zhao, Z.¹ Braams, B.J.² Fukuda, H.³ Overton, M.L.⁴ Percus, J.K.⁵

7
- 33645502170
- ACHRE4 0001-4842 10.1021/ar050029d
- D.A. Mazziotti, Acc. Chem. Res. 39, 207 (2006). ACHRE4 0001-4842 10.1021/ar050029d
- (2006) Acc. Chem. Res. , vol.39 , pp. 207
- Mazziotti, D.A.¹

8
- 0000516431
- PLRAAN 1050-2947 10.1103/PhysRevA.47.979
- F. Colmenero and C. Valdemoro, Phys. Rev. A 47, 979 (1993); PLRAAN 1050-2947 10.1103/PhysRevA.47.979
- (1993) Phys. Rev. A , vol.47 , pp. 979
- Colmenero, F.¹ Valdemoro, C.²

9
- 0032095334
- PLRAAN 1050-2947 10.1103/PhysRevA.57.4219
- D.A. Mazziotti, Phys. Rev. A 57, 4219 (1998); PLRAAN 1050-2947 10.1103/PhysRevA.57.4219
- (1998) Phys. Rev. A , vol.57 , pp. 4219
- Mazziotti, D.A.¹

10
- 3242891985
- PRLTAO 0031-9007 10.1103/PhysRevLett.76.1039
- H. Nakatsuji and K. Yasuda, Phys. Rev. Lett. 76, 1039 (1996). PRLTAO 0031-9007 10.1103/PhysRevLett.76.1039
- (1996) Phys. Rev. Lett. , vol.76 , pp. 1039
- Nakatsuji, H.¹ Yasuda, K.²

11
- 33749493256
- PRLTAO 0031-9007 10.1103/PhysRevLett.97.143002
- D.A. Mazziotti, Phys. Rev. Lett. 97, 143002 (2006); PRLTAO 0031-9007 10.1103/PhysRevLett.97.143002
- (2006) Phys. Rev. Lett. , vol.97 , pp. 143002
- Mazziotti, D.A.¹

12
- 33846977372
- PLRAAN 1050-2947 10.1103/PhysRevA.75.022505
- D.A. Mazziotti Phys. Rev. A 75, 022505 (2007); PLRAAN 1050-2947 10.1103/PhysRevA.75.022505
- (2007) Phys. Rev. A , vol.75 , pp. 022505
- Mazziotti, D.A.¹

13
- 36048989623
- PLRAAN 1050-2947 10.1103/PhysRevA.76.052502
- D.A. Mazziotti Phys. Rev. A 76, 052502 (2007). PLRAAN 1050-2947 10.1103/PhysRevA.76.052502
- (2007) Phys. Rev. A , vol.76 , pp. 052502
- Mazziotti, D.A.¹

14
- 33748268673
- JCPSA6 0021-9606 10.1063/1.2336210
- C. Kollmar, J. Chem. Phys. 125, 084108 (2006). JCPSA6 0021-9606 10.1063/1.2336210
- (2006) J. Chem. Phys. , vol.125 , pp. 084108
- Kollmar, C.¹

15
- 34948825483
- PLRAAN 1050-2947 10.1103/PhysRevA.76.042501
- A.E. DePrince and D.A. Mazziotti, Phys. Rev. A PLRAAN 1050-2947 76, 042501 (2007); 10.1103/PhysRevA.76.042501
- (2007) Phys. Rev. A , vol.76 , pp. 042501
- Deprince, A.E.¹ Mazziotti, D.A.²

16
- 47249092176
- JCPSA6 0021-9606 10.1063/1.2937454
- A.E. DePrince, E. Kamarchik, and D.A. Mazziotti, J. Chem. Phys. 128, 234103 (2008). JCPSA6 0021-9606 10.1063/1.2937454
- (2008) J. Chem. Phys. , vol.128 , pp. 234103
- Deprince, A.E.¹ Kamarchik, E.² Mazziotti, D.A.³

17
- 36549102041
- JCPSA6 0021-9606 10.1063/1.448517
- R. Ahlrichs, P. Scharf, and C. Ehrhardt, J. Chem. Phys. 82, 890 (1985). JCPSA6 0021-9606 10.1063/1.448517
- (1985) J. Chem. Phys. , vol.82 , pp. 890
- Ahlrichs, R.¹ Scharf, P.² Ehrhardt, C.³

18
- 84893169025
- JCCHDD 0192-8651 10.1002/jcc.540141112
- M.W. Schmidt, K.K. Bladridge, and J.A. Boatz, J. Comput. Chem. 14, 1347 (1993). JCCHDD 0192-8651 10.1002/jcc.540141112
- (1993) J. Comput. Chem. , vol.14 , pp. 1347
- Schmidt, M.W.¹ Bladridge, K.K.² Boatz, J.A.³

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.