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Results:
1-25
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Results: 25
Authors:
Kowalski, K
Piecuch, P
Citation: K. Kowalski et P. Piecuch, Extension of the method of moments of coupled-cluster equations to a multireference wave operator formalism, J MOL ST-TH, 547, 2001, pp. 191-208
Authors:
Kowalski, K
Piecuch, P
Citation: K. Kowalski et P. Piecuch, New type of noniterative energy corrections for excited electronic states:Extension of the method of moments of coupled-cluster equations to the equation-of-motion coupled-cluster formalism, J CHEM PHYS, 115(7), 2001, pp. 2966-2978
Authors:
Kowalski, K
Piecuch, P
Citation: K. Kowalski et P. Piecuch, The active-space equation-of-motion coupled-cluster methods for excited electronic states: Full EOMCCSDt, J CHEM PHYS, 115(2), 2001, pp. 643-651
Authors:
Jasper, AW
Hack, MD
Chakraborty, A
Truhlar, DG
Piecuch, P
Citation: Aw. Jasper et al., Photodissociation of LiFH and NaFH van der Waals complexes: A semiclassical trajectory study, J CHEM PHYS, 115(17), 2001, pp. 7945-7952
Authors:
Piecuch, P
Kucharski, SA
Spirko, V
Kowalski, K
Citation: P. Piecuch et al., Can ordinary single-reference coupled-cluster methods describe potential energy surfaces with nearly spectroscopic accuracy? The renormalized coupled-cluster study of the vibrational spectrum of HF, J CHEM PHYS, 115(13), 2001, pp. 5796-5804
Authors:
Kowalski, K
Piecuch, P
Citation: K. Kowalski et P. Piecuch, Excited-state potential energy curves of CH+: a comparison of the EOMCCSDtand full EOMCCSDT results, CHEM P LETT, 347(1-3), 2001, pp. 237-246
Authors:
Kowalski, K
Piecuch, P
Citation: K. Kowalski et P. Piecuch, A comparison of the renormalized and active-space coupled-cluster methods:Potential energy curves of BH and F-2, CHEM P LETT, 344(1-2), 2001, pp. 165-175
Authors:
Piecuch, P
Kucharski, SA
Kowalski, K
Citation: P. Piecuch et al., Can ordinary single-reference coupled-cluster methods describe the potential energy curve of N-2? The renormalized CCSDT(Q) study, CHEM P LETT, 344(1-2), 2001, pp. 176-184
Authors:
Fuzery, AK
Burcl, R
Torday, LL
Csaszar, P
Farkas, O
Perczel, A
Zamora, MA
Papp, JG
Penke, B
Piecuch, P
Csizmadia, IG
Citation: Ak. Fuzery et al., Can NO2+ exist in bent or cyclic forms?, CHEM P LETT, 334(4-6), 2001, pp. 381-386
Authors:
Kowalski, K
Piecuch, P
Citation: K. Kowalski et P. Piecuch, The state-universal multi-reference coupled-cluster theory with perturbative description of core-virtual excitations, CHEM P LETT, 334(1-3), 2001, pp. 89-98
Authors:
Sekusak, S
Piecuch, P
Bartlett, RJ
Cory, MG
Citation: S. Sekusak et al., A general reaction path dual-level direct dynamics calculation of the reaction of hydroxyl radical with dimethyl sulfide, J PHYS CH A, 104(38), 2000, pp. 8779-8786
Authors:
Kowalski, K
Piecuch, P
Citation: K. Kowalski et P. Piecuch, Complete set of solutions of multireference coupled-cluster equations: Thestate-universal formalism - art. no. 052506, PHYS REV A, 6105(5), 2000, pp. 2506
Authors:
Piecuch, P
Landman, JI
Citation: P. Piecuch et Ji. Landman, Parallelization of multi-reference coupled-cluster method, PARALLEL C, 26(7-8), 2000, pp. 913-943
Authors:
Mrugala, F
Piecuch, P
Spirko, V
Bludsky, O
Citation: F. Mrugala et al., Lifetimes and dissociation pathways of the quasi-bound states of the Na center dot center dot center dot FH van der Waals molecule, J MOL STRUC, 555, 2000, pp. 43-60
Authors:
Hudson, AJ
Oh, HB
Polanyi, JC
Piecuch, P
Citation: Aj. Hudson et al., Dynamics of harpooning studied by transition state spectroscopy. II. Li center dot center dot FH, J CHEM PHYS, 113(22), 2000, pp. 9897-9900
Authors:
Kowalski, K
Piecuch, P
Citation: K. Kowalski et P. Piecuch, The active-space equation-of-motion coupled-cluster methods for excited electronic states: The EOMCCSDt approach, J CHEM PHYS, 113(19), 2000, pp. 8490-8502
Authors:
Kowalski, K
Piecuch, P
Citation: K. Kowalski et P. Piecuch, Renormalized CCSD(T) and CCSD(TQ) approaches: Dissociation of the N-2 triple bond, J CHEM PHYS, 113(14), 2000, pp. 5644-5652
Authors:
Kowalski, K
Piecuch, P
Citation: K. Kowalski et P. Piecuch, The method of moments of coupled-cluster equations and the renormalized CCSD[T], CCSD(T), CCSD(TQ), and CCSDT(Q) approaches, J CHEM PHYS, 113(1), 2000, pp. 18-35
Authors:
Spirko, V
Piecuch, P
Bludsky, O
Citation: V. Spirko et al., Bound and quasibound states of the Na center dot center dot center dot FH van der Waals molecule, J CHEM PHYS, 112(1), 2000, pp. 189-202
Authors:
Kowalski, K
Piecuch, P
Citation: K. Kowalski et P. Piecuch, Complete set of solutions of the generalized Bloch equation, INT J QUANT, 80(4-5), 2000, pp. 757-781
Authors:
Burcl, R
Piecuch, P
Spirko, V
Bludsky, O
Citation: R. Burcl et al., Bound and quasi-bound states of the Li center dot center dot center dot FHvan der Waals molecule, INT J QUANT, 80(4-5), 2000, pp. 916-933
Authors:
Piecuch, P
Bartlett, RJ
Citation: P. Piecuch et Rj. Bartlett, EOMXCC: A new coupled-cluster method for electronic excited states, ADV QUANT C, 34, 1999, pp. 295-380
Authors:
Piecuch, P
Kucharski, SA
Spirko, V
Citation: P. Piecuch et al., Coupled-cluster methods with internal and semi-internal triply excited clusters: Vibrational spectrum of the HF molecule, J CHEM PHYS, 111(15), 1999, pp. 6679-6692
Authors:
Piecuch, P
Kucharski, SA
Bartlett, RJ
Citation: P. Piecuch et al., Coupled-cluster methods with internal and semi-internal triply and quadruply excited clusters: CCSDt and CCSDtq approaches, J CHEM PHYS, 110(13), 1999, pp. 6103-6122
Authors:
Topaler, M
Piecuch, P
Truhlar, DG
Citation: M. Topaler et al., Infrared absorption line strengths of the Na center dot center dot center dot FH van der Waals molecule, J CHEM PHYS, 110(12), 1999, pp. 5634-5638
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