424 related articles for article (PubMed ID: 21303098)
1. Explicitly time-dependent coupled cluster singles doubles calculations of laser-driven many-electron dynamics.
Huber C; Klamroth T
J Chem Phys; 2011 Feb; 134(5):054113. PubMed ID: 21303098
[TBL] [Abstract][Full Text] [Related]
2. Time-dependent configuration-interaction calculations of laser-pulse-driven many-electron dynamics: controlled dipole switching in lithium cyanide.
Krause P; Klamroth T; Saalfrank P
J Chem Phys; 2005 Aug; 123(7):074105. PubMed ID: 16229557
[TBL] [Abstract][Full Text] [Related]
3. New coupled-cluster methods with singles, doubles, and noniterative triples for high accuracy calculations of excited electronic states.
Kowalski K; Piecuch P
J Chem Phys; 2004 Jan; 120(4):1715-38. PubMed ID: 15268302
[TBL] [Abstract][Full Text] [Related]
4. On the accuracy of computed excited-state dipole moments.
King RA
J Phys Chem A; 2008 Jun; 112(25):5727-33. PubMed ID: 18517183
[TBL] [Abstract][Full Text] [Related]
5. Electronic optical response of molecules in intense fields: comparison of TD-HF, TD-CIS, and TD-CIS(D) approaches.
Schlegel HB; Smith SM; Li X
J Chem Phys; 2007 Jun; 126(24):244110. PubMed ID: 17614540
[TBL] [Abstract][Full Text] [Related]
6. Second- and third-order triples and quadruples corrections to coupled-cluster singles and doubles in the ground and excited states.
Shiozaki T; Hirao K; Hirata S
J Chem Phys; 2007 Jun; 126(24):244106. PubMed ID: 17614536
[TBL] [Abstract][Full Text] [Related]
7. Ground and electronically excited states of methyl hydroperoxide: comparison with hydrogen peroxide.
Watts JD; Francisco JS
J Chem Phys; 2006 Sep; 125(10):104301. PubMed ID: 16999520
[TBL] [Abstract][Full Text] [Related]
8. Explicitly correlated coupled-cluster theory using cusp conditions. I. Perturbation analysis of coupled-cluster singles and doubles (CCSD-F12).
Köhn A; Tew DP
J Chem Phys; 2010 Nov; 133(17):174117. PubMed ID: 21054016
[TBL] [Abstract][Full Text] [Related]
9. The p-difluorobenzene-argon S1 excited state intermolecular potential energy surface.
Fajín JL; Fernandez B; Felker PM
J Phys Chem A; 2006 Dec; 110(49):13259-63. PubMed ID: 17149844
[TBL] [Abstract][Full Text] [Related]
10. Explicitly correlated combined coupled-cluster and perturbation methods.
Shiozaki T; Valeev EF; Hirata S
J Chem Phys; 2009 Jul; 131(4):044118. PubMed ID: 19655848
[TBL] [Abstract][Full Text] [Related]
11. Explicitly correlated equation-of-motion coupled-cluster methods for excited and electron-attached states.
Bokhan D; Ten-No S
J Chem Phys; 2010 Nov; 133(20):204103. PubMed ID: 21133437
[TBL] [Abstract][Full Text] [Related]
12. Simple coupled-cluster singles and doubles method with perturbative inclusion of triples and explicitly correlated geminals: The CCSD(T)R12 model.
Valeev EF; Daniel Crawford T
J Chem Phys; 2008 Jun; 128(24):244113. PubMed ID: 18601323
[TBL] [Abstract][Full Text] [Related]
13. Highly accurate CCSD(R12) and CCSD(F12) optical response properties using standard triple-zeta basis sets.
Yang J; Hättig C
J Chem Phys; 2009 Aug; 131(7):074102. PubMed ID: 19708727
[TBL] [Abstract][Full Text] [Related]
14. Basis set and electron correlation effects on the polarizability and second hyperpolarizability of model open-shell pi-conjugated systems.
Champagne B; Botek E; Nakano M; Nitta T; Yamaguchi K
J Chem Phys; 2005 Mar; 122(11):114315. PubMed ID: 15839724
[TBL] [Abstract][Full Text] [Related]
15. The fluorobenzene-argon S(1) excited-state intermolecular potential energy surface.
Fajín JL; Capelo SB; Fernandez B; Felker PM
J Phys Chem A; 2007 Aug; 111(32):7876-81. PubMed ID: 17658771
[TBL] [Abstract][Full Text] [Related]
16. Implementation of transition moments between excited states in the approximate coupled-cluster singles and doubles model.
Pabst M; Köhn A
J Chem Phys; 2008 Dec; 129(21):214101. PubMed ID: 19063538
[TBL] [Abstract][Full Text] [Related]
17. Third- and fourth-order perturbation corrections to excitation energies from configuration interaction singles.
Hirata S
J Chem Phys; 2005 Mar; 122(9):094105. PubMed ID: 15836110
[TBL] [Abstract][Full Text] [Related]
18. A modified ansatz for explicitly correlated coupled-cluster wave functions that is suitable for response theory.
Köhn A
J Chem Phys; 2009 Mar; 130(10):104104. PubMed ID: 19292520
[TBL] [Abstract][Full Text] [Related]
19. Theoretical spectroscopy of the calcium dimer in the A 1Sigma(u)+, c3Pi(u), and a3Sigma(u)+ manifolds: an ab initio nonadiabatic treatment.
Bussery-Honvault B; Launay JM; Korona T; Moszynski R
J Chem Phys; 2006 Sep; 125(11):114315. PubMed ID: 16999482
[TBL] [Abstract][Full Text] [Related]
20. Improving upon the accuracy for doubly excited states within the coupled cluster singles and doubles theory.
Kuś T; Bartlett RJ
J Chem Phys; 2009 Sep; 131(12):124310. PubMed ID: 19791884
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]