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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

MULTICONFIGURATION SELF-CONSISTENT FIELD THEORY OF LOCALIZED ORBITALS: THE SECULAR PROBLEM.SCHLOSSER H.1975; CHEM. PHYS. LETTERS; NETHERL.; DA. 1975; VOL. 35; NO 2; PP. 239-242; BIBL. 4 REF.Article

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

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

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

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

CALCUL DE QUELQUES ETATS ATOMIQUES EXCITESKANTSERYANICHYUS A YU.1975; LITOV. FIZ. SBOR.; S.S.S.R.; DA. 1975; VOL. 15; NO 3; PP. 359-368; ABS. LITU. ANGL.; BIBL. 16 REF.Article

CALCUL NON EMPIRIQUE DE SPECTRE DE RAYONS X DE LA MOLECULE HCL. IIMAZALOV LN; MURAKHTANOV VV; GUZHAVINA TI et al.1975; ZH. STRUKT. KHIM.; S.S.S.R.; DA. 1975; VOL. 16; NO 2; PP. 267-270; BIBL. 2 REF.Article

A CORRELATION STUDY OF LI GROUND STATE BY THE MCHF PROCEDURE.FISCHER CF.1975; INTERNATION. J. QUANTUM CHEM.; U.S.A.; DA. 1975; VOL. 9; NO 2; PP. 273-285; ABS. FR. ALLEM.; BIBL. 13 REF.Article

AB-INITIO INTERPRETATION OF <R-3> ELECTRONIC QUANTITIES IN THE HFS OF MG I 3S 3P 3P AND 1P.BAUCHE J; COUARRAZE G; LABARTHE JJ et al.1974; Z. PHYS.; DTSCH.; DA. 1974; VOL. 270; NO 4; PP. 311-318; BIBL. 25 REF.Article

MULTI-CONFIGURATION HARTREE-FOCK THEORY WITH NON-ORTHOGONAL ORBITALSKVASNICKA V; LAURING V.1973; CHEM. PHYS. LETTERS; NETHERL.; DA. 1973; VOL. 18; NO 3; PP. 375-379; BIBL. 17 REF.Serial Issue

AB INITIO CALCULATION OF THE HELIUM-HELIUM X1SIGMA G+ POTENTIAL AT INTERMEDIATE AND LARGE SEPARATIONS. II. CHANGES IN INTRA-ATOMIC CORRELATION ENERGYBERTONCINI PJ; WAHL AC.1973; J. CHEM. PHYS.; U.S.A.; DA. 1973; VOL. 58; NO 3; PP. 1259-1261; BIBL. 11 REF.Serial Issue

EFFECTIVE HAMILTONIANS AND ORBITAL OPTIMIZATION.MCVVEENY R.1975; CHEM. PHYS. LETTERS; NETHERL.; DA. 1975; VOL. 35; NO 1; PP. 13-16; BIBL. 10 REF.Article

THE CONVERGENCE PROPERTIES OF DIRECT ENERGY MINIMISATION WITH RESPECT TO LINEAR COEFFICIENTS IN THE MC-LCAO-MO-SCF APPROACH.SUTCLIFFE BT.1975; THEOR. CHIM. ACTA; ALLEM.; DA. 1975; VOL. 39; NO 1; PP. 93-102; BIBL. 9 REF.Article

THEORETICAL OSCILLATOR STRENGTHS FOR NP->ND TRANSITIONS IN MG.FROESE FISCHER C.1975; CANAD. J. PHYS.; CANADA; DA. 1975; VOL. 53; NO 2; PP. 184-191; ABS. FR.; BIBL. 16 REF.Article

OSCILLATOR STRENGHTS OF SOME BA LINES, CALCULATED IN MCHF APPROXIMATION.MCCAVERT P; TREFFTZ E.1974; J. PHYS., B; G.B.; DA. 1974; VOL. 7; NO 11; PP. 1270-1278; BIBL. 13 REF.Article

SIMPLIFIED MULTICONFIGURATION SELF-CONSISTENT FIELD THEORY FOR LOCALIZED ORBITALS. III. EVALUATION OF OPERATORS AND MATRIX ELEMENTS.SCHLOSSER H.1974; J. CHEM. PHYS.; U.S.A.; DA. 1974; VOL. 61; NO 7; PP. 2814-2819; BIBL. 20 REF.Article

THE 1AAPI ->PI * STATE OF FORMALDEHYDE.LANGHOFF SR; ELBERT ST; JACKELS CF et al.1974; CHEM. PHYS. LETTERS; NETHERL.; DA. 1974; VOL. 29; NO 2; PP. 247-249; BIBL. 8 REF.Article

THE RAYLEIGH-SCHROEDINGER PERTURBATION AND THE LINKED-DIAGRAM THEOREM FOR A MULTI-CONFIGURATIONAL MODEL SPACE.LINDGREN I.1974; J. PHYS. B; G.B.; DA. 1974; VOL. 7; NO 18; PP. 2441-2470; BIBL. 32 REF.Article

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