Direct one-index transformations in multiconfiguration response calculationsVAHTRAS, O; ÅGREN, H; JENSEN, H. J. A. A et al.Journal of computational chemistry. 1994, Vol 15, Num 6, pp 573-579, issn 0192-8651Article

MULTI-CONFIGURATIONAL COMPLEX MOLECULAR ORBITAL METHODHENDEKOVIC J.1979; CHEM. PHYS.; NLD; DA. 1979; VOL. 41; NO 1-2; PP. 67-80; BIBL. 12 REF.Article

ATOMIC ENERGY LEVELS DERIVED FROM THEORETICAL CALCULATIONS: 1S²2S²NS SERIES OF BORON I.SAXENA KMS; FRAGA S.1977; AN. FIS.; ESP.; DA. 1977; VOL. 73; NO 4; PP. 294-295; ABS. ESP.; BIBL. 3 REF.Article

SIZE-CONSISTENT METHODS AS STARTING POINTS FOR CALCULATIONS WITH MULTI-CONFIGURATIONAL REFERENCE FUNCTIONSWENZEL KB.1982; J. PHYS. B; ISSN 0022-3700; GBR; DA. 1982; VOL. 15; NO 6; PP. 835-852; BIBL. 33 REF.Article

RELATIVISTIC ATOMIC STRUCTURE CALCULATIONSGRANT IP.1979; COMPUTER PHYS. COMMUNIC.; NLD; DA. 1979; VOL. 17; NO 1-2; PP. 149-161; BIBL. 47 REF.Conference Paper

SECOND AND THIRD DERIVATIVES OF VARIATIONAL ENERGY EXPRESSIONS: APPLICATION TO MULTICONFIGURATIONAL SELF-CONSISTENT FIELD WAVE FUNCTIONSPULAY P.1983; JOURNAL OF CHEMICAL PHYSICS; ISSN 0021-9606; USA; DA. 1983; VOL. 78; NO 8; PP. 5043-5051; BIBL. 35 REF.Article

A NEW ALGORITHM FOR THE EVALUATION OF VECTOR-COUPLING COEFFICIENTS IN AN MCSCF/CI STUDYDAS G.1982; J. PHYS. CHEM.; ISSN 0022-3654; USA; DA. 1982; VOL. 86; NO 7; PP. 1096-1098; BIBL. 4 REF.Article

Multiple stationary point representations in MC SCF calculationsGOLAB, J. T; YEAGER, D. L; JØRGENSEN, P et al.Chemical physics. 1985, Vol 93, Num 1, pp 83-100, issn 0301-0104Article

A new determinant-based full configuration interaction methodKNOWLES, P. J; HANDY, N. C.Chemical physics letters. 1984, Vol 111, Num 4-5, pp 315-321, issn 0009-2614Article

COMMENT ON THE USE OF THE AUGMENTED MATRIX IN MCSCF THEORYYARKONY DR.1981; CHEM. PHYS. LETT.; ISSN 0009-2614; NLD; DA. 1981; VOL. 77; NO 3; PP. 634-635; BIBL. 9 REF.Article

PROGRAMME COMPLEXE D'APPLICATION DE LA METHODE SCF AUX APPROXIMATIONS MONO- ET MULTICONFIGURATIONNELLESKUPRIEVICH VA; KLIMENKO VE.1978; ZH. STRUKT. KHIM.; SUN; DA. 1978; VOL. 19; NO 4; PP. 729-730; BIBL. 7 REF.Article

Low-lying D states of Be IFISCHER, C. F.Physical review. A, General physics. 1984, Vol 30, Num 5, pp 2741-2744, issn 0556-2791Article

MCDF calculation of argon Auger processBRUNEAU, J.Journal of physics. B. Atomic and molecular physics. 1983, Vol 16, Num 22, pp 4135-4151, issn 0022-3700Article

State dependent volume isotope shift analysis of the low lying states of Ba I and Ba IIFRICKE, B; GRUNDEVIK, P; LINDGREN, I et al.Physics letters. A. 1983, Vol 97, Num 5, pp 183-186, issn 0375-9601Article

A direct approach to second-order MCSCF calculations using a norm extended optimization schemeJENSEN, H. J. A; JORGENSEN, P.The Journal of chemical physics. 1984, Vol 80, Num 3, pp 1204-1214, issn 0021-9606Article

On the calculation of transition moments between states described in different orbital basisBAUSCHLICHER, C. W. JR.Journal of computational chemistry. 1984, Vol 5, Num 5, pp 500-505, issn 0192-8651Article

Calculations of the ground-state correlation energy of the Be atom using multiconfigurational perturbation theoryIIJIMA, N; IWAI, M; SAIKA, A et al.Chemical physics letters. 1983, Vol 102, Num 2-3, pp 213-215, issn 0009-2614Article

First and second anharmonicities of the MCSCF energySIMONS, J; JØRGENSEN, P.The Journal of chemical physics. 1983, Vol 79, Num 7, pp 3599-3600, issn 0021-9606Article

The multi-configurational time-dependent Hartree approachMEYER, H.-D; MANTHE, U; CEDERBAUM, L. S et al.Chemical physics letters. 1990, Vol 165, Num 1, pp 73-78, issn 0009-2614, 6 p.Article

An MC-SCF procedure using an orthogonal transformation represented by a direct sum of two-by-two rotationsIGAWA, A.International journal of quantum chemistry. 1985, Vol 28, Num 2, pp 203-211, issn 0020-7608Article

Parametrization of molecular orbital transformationsKING, H. F; CAMP, R. N; MCLVER, J. W. JR et al.The Journal of chemical physics. 1984, Vol 80, Num 3, pp 1171-1174, issn 0021-9606Article

Theoretical study of the correlation and relativistic effects in the shakeup in the photoelectron spectrum of cesiumDE ALTI, G; DECLEVA, P; LISINI, A et al.The Journal of chemical physics. 1984, Vol 81, Num 12, pp 5241-5246, issn 0021-9606, 1Article

Crossed-second-order specific-mass isotope shift in the nickel atomFONSECA, A. L. A; BAUCHE, J.Zeitschrift für Physik. A, Atoms and nuclei. 1983, Vol 314, Num 3, pp 275-282, issn 0340-2193Article

The virial theorem as an entail for Koopman's theorem in atomic calculationsCUSTODIO, R.Theoretica chimica acta. 1985, Vol 67, Num 4, pp 307-313, issn 0040-5744Article

Energy levels of atomic nitrogen calculated in a multiconfiguration optimized potential modelAASHAMAR, K; LUKE, T. M; TALMAN, J. D et al.Physica scripta (Print). 1983, Vol 27, Num 4, pp 267-274, issn 0031-8949Article