Size extensivity correction for complete active space multiconfiguration self-consistent-field configuration interaction energiesSIMONS, J.Journal of physical chemistry (1952). 1989, Vol 93, Num 2, pp 626-627, issn 0022-3654Article

Novel Approach to Excited-State Calculations of Large Molecules Based on Divide-and-Conquer Method: Application to Photoactive Yellow ProteinYOSHIKAWA, Takeshi; KOBAYASHI, Masato; FUJII, Atsuhiko et al.The Journal of physical chemistry. B. 2013, Vol 117, Num 18, pp 5565-5573, issn 1520-6106, 9 p.Article

Photoelectron Spectra of Some Important Biological Molecules: Symmetry-Adapted-Cluster Configuration Interaction StudyFARROKHPOUR, Hossein; GHANDEHARI, Maryam.The Journal of physical chemistry. B. 2013, Vol 117, Num 20, pp 6027-6041, issn 1520-6106, 15 p.Article

Weakly nonuncoupled relations in wave multiple scattering theory for dense discrete random mediaBARABANENKOV, YU. N; KALININ, M. I.Physics letters. A. 1992, Vol 163, Num 3, pp 214-218, issn 0375-9601Article

Conservative configuration dependent loads on bounded surfacesFISHER, D.Zeitschrift für angewandte Mathematik und Physik. 1987, Vol 38, Num 6, pp 883-892, issn 0044-2275Article

Resolutions of the Coulomb operator Part III. Reduced-rank Schrödinger equationsLIMPANUPARB, Taweetham; GILL, Peter M. W.PCCP. Physical chemistry chemical physics (Print). 2009, Vol 11, Num 40, pp 9176-9181, issn 1463-9076, 6 p.Article

New concepts in bonded functions theory. III: Orthogonalization problemGOŁEBIEWSKI, A; BROCŁAWIK, E; VITKO, M et al.International journal of quantum chemistry. 1989, Vol 35, Num 3, pp 425-432, issn 0020-7608Article

Calculation of S_N¹+N²⊃S_N¹⊗S_N² and U(n₁+n₂)⊃U(n₁)⊗U(n₂) subduction coefficients by using spin graphWEN ZHENYI.International journal of quantum chemistry. 1986, Vol 29, Num 6, pp 1779-1787, issn 0020-7608Article

On the invariance of the configuration interaction energy with respect to orbital rotationsBAUSCHLICHER, C. W; PARTRIDGE, H.Theoretica chimica acta. 1993, Vol 85, Num 4, pp 255-259, issn 0040-5744Article

Nonrelativistic energy of the ground stateJITRIK, O; BUNGE, C. F.Physical review. A. 1991, Vol 43, Num 11, pp 5804-5809, issn 1050-2947Article

Vectorizable approach to molecular CI problems using determinantal basisZARRABIAN, S; SARMA, C. R; PALDUS, J et al.Chemical physics letters. 1989, Vol 155, Num 2, pp 183-188, issn 0009-2614Article

Quadratic configuration interaction: reply to comment by Paldus, Cizek, and JeziorskiPOPLE, J. A; HEAD-GORDON, M; KRISHNAN RAGHAVACHARI et al.The Journal of chemical physics. 1989, Vol 90, Num 8, pp 4635-4636, issn 0021-9606, 2 p.Article

A formulation of multiple-reference CI with terms linear in the interelectronic distancesGDANITZ, R. J.Chemical physics letters. 1993, Vol 210, Num 1-3, pp 253-260, issn 0009-2614Article

Precise calculation of the Stark shift of the lithium D1 linePIPIN, J; BISHOP, D. M.Physical review. A. 1993, Vol 47, Num 6A, pp R4571-R4572, issn 1050-2947Article

A unitary group formulation of the complete active space configuration interaction method. II: An approach based on the subgroup chain U(n=n₀+n₁+n₂)#74U(n₀)×U(n₁+n₂)#74U(n₀)×U(n₁)×U(n₂)BURTON, P. J; GOULD, M. D.The Journal of chemical physics. 1992, Vol 96, Num 7, pp 5261-5271, issn 0021-9606Article

Four self-consistent dressings to achieve size-consistency of singles and doubles configuration interactionHEULLY, J.-L; MALRIEU, J.-P.Chemical physics letters. 1992, Vol 199, Num 6, pp 545-550, issn 0009-2614Article

Multiple bonding in perfluorodiphosphene (FPPF) and perfluorodiphosphinylidene (PPF₂)SUQIAN JIN; THIES COLEGROVE, B; SCHAFER, H. F et al.Inorganic chemistry (Print). 1991, Vol 30, Num 15, pp 2969-2977, issn 0020-1669Article

On natural orbitals for propertiesCEDERBAUM, L. S; MEYER, H.-D.Chemical physics letters. 1991, Vol 181, Num 2-3, pp 163-167, issn 0009-2614Article

Oscillator strengths of the 1s2s ¹S^e→1s2p ¹P⁰ transition in HeTIWARY, S. N; KUMAR, P.Acta physica Polonica. A. 1991, Vol 80, Num 1, pp 23-28, issn 0587-4246Article

Variation determination of optimal orbitals for electron scatteringHINZE, J; HAMACHER, P.The Journal of chemical physics. 1990, Vol 92, Num 7, pp 4372-4373, issn 0021-9606Article

Electronic and vibrational transitions observed in collisions between C₂⁺ and HeHAMDAN, M; CURCURUTO, O; TRALDI, P et al.International journal of mass spectrometry and ion processes. 1990, Vol 96, Num 1, pp 69-76, issn 0168-1176Article

Singlet-triplet energy gaps in chlorine-substituted methylenes and silylenesSEUNG KOO SHIN; GODDARD, W. A; BEAUCHAMP, J. L et al.Journal of physical chemistry (1952). 1990, Vol 94, Num 18, pp 6963-6969, issn 0022-3654Article

Some properties of symmetrized transition density matrices based on configuration interaction wavefunctionsGULDBERG, A.Chemical physics letters. 1989, Vol 154, Num 5, pp 487-491, issn 0009-2614Article

Interconfigurational interactions and tensor operator equivalentsTUSZYNSKI, J. A; DIXON, J. M.Physica. A. 1988, Vol 147, Num 3, pp 544-554, issn 0378-4371Article

Electric dipole transitions in atomic oxygen and the lifetimes of the 2p³ (⁴S⁰) 3s ⁵S⁰ and ³S⁰ statesBIEMONT, E; ZEIPPEN, C. J.Astronomy and astrophysics (Berlin. Print). 1992, Vol 265, Num 2, pp 850-856, issn 0004-6361Article