GEOMETRIES AND RELATIVE ENERGIES OF SINGLET SILYLSILYLENE AND SINGLET DISILENEKROGH JESPERSEN K.1982; J. PHYS. CHEM.; ISSN 0022-3654; USA; DA. 1982; VOL. 86; NO 9; PP. 1492-1495; BIBL. 17 REF.Article

ELECTRONIC STATES AND BARRIERS TO INTERNAL ROTATION IN SILAALLENESKROGH JESPERSEN K.1982; JOURNAL OF COMPUTATIONAL CHEMISTRY; ISSN 0192-8651; USA; DA. 1982; VOL. 3; NO 4; PP. 571-579; BIBL. 34 REF.Article

ON THE STABILITY OF AZIRINYL AND DIAZIRINYL CATIONSKROGH JESPERSEN K.1980; TETRAHEDRON LETT.; ISSN 0040-4039; GBR; DA. 1980; VOL. 21; NO 47; PP. 4553-4556; BIBL. 15 REF.Article

ESTIMATION OF INTRAMOLECULAR POLARON COUPLING CONSTANTS FOR TETRACYANOQUINODIMETHAN AND ITS ANION.KROGH JESPERSEN K; RATNER MA.1976; CHEM. PHYS. LETTERS; NETHERL.; DA. 1976; VOL. 39; NO 1; PP. 123-127; BIBL. 27 REF.Article

THE SCREENED INDO (INDO/S) MODEL: APPLICATION TO PHOTOELECTRON SPECTRUM OF BENZONITRILE.KROGH JESPERSEN K; RATNER M.1976; J. CHEM. PHYS.; U.S.A.; DA. 1976; VOL. 65; NO 4; PP. 1305-1309; BIBL. 25 REF.Article

REACTIVITY OF AN AMBIPHILIC CARBENE. A NONLINEAR HAMMETT CORRELATIONMOSS RA; GUO W; KROGH JESPERSEN K et al.1982; TETRAHEDRON LETT.; ISSN 0040-4039; GBR; DA. 1982; VOL. 23; NO 1; PP. 15-18; BIBL. 20 REF.Article

Ab initio electronic structure calculations on the benzene dication and other C₆H₆²⁺ isomersKROGH-JESPERSEN, K.Journal of the American Chemical Society. 1991, Vol 113, Num 2, pp 417-423, issn 0002-7863Article

THE 51000 CM^-1 STATE IN BENZENE: E_1G RYDBERG OR E_2G VALENCE.KROGH JESPERSEN K; RAVA RP; GOODMAN L et al.1979; CHEM. PHYS. LETTERS; NLD; DA. 1979; VOL. 64; NO 3; PP. 413-416; BIBL. 20 REF.Article

VIBRONIC MECHANISMS IN THE TWO-PHOTON SPECTRUM OF BENZENERAVA RP; GOODMAN L; KROGH JESPERSEN K et al.1981; J. CHEM. PHYS.; ISSN 0021-9606; USA; DA. 1981; VOL. 74; NO 1; PP. 273-281; BIBL. 45 REF.Article

DEUTERIUM EFFECT ON THE BENZENE TWO-PHOTON ¹B_2U<-¹A_1G SPECTRUMRAVA RP; GOODMAN L; KROGH JESPERSEN K et al.1979; CHEM. PHYS. LETTERS; NLD; DA. 1979; VOL. 68; NO 2-3; PP. 337-340; BIBL. 15 REF.Article

The glycine zwitterion does not exist in the gas phase : results from a detailed ab initio electronic structure studyYANBO DING; KROGH-JESPERSEN, K.Chemical physics letters. 1992, Vol 199, Num 3-4, pp 261-266, issn 0009-2614Article

CARBENIC PHILICITY: 6,6-DIMETHYLFULVENE AS AN INDICATOR SUBSTRATEMOSS RA; YOUNG CM; PEREZ LA et al.1981; J. AM. CHEM. SOC.; ISSN 0002-7863; USA; DA. 1981; VOL. 103; NO 9; PP. 2413-2415; BIBL. 30 REF.Article

NONPLANAR STRUCTURES OF CYCLOBUTADIENE DICATIONS.KROGH JESPERSEN K; VON RAGUE SCHLEYER P; POPLE JA et al.1978; J. AMER. CHEM. SOC.; USA; DA. 1978; VOL. 100; NO 13; PP. 4301-4302; BIBL. 14 REF.Article

PHENOXYCHLOROCARBENE, A SECOND AMBIPHILEMOSS RA; PEREZ LA; WLOSTOWSKA J et al.1982; J. ORG. CHEM.; ISSN 0022-3263; USA; DA. 1982; VOL. 47; NO 22; PP. 4177-4180; BIBL. 33 REF.Article

PHOTOCHEMISTRY OF BETA ,GAMMA -UNSATURATED KETONES. SPECIFIC REACTIVITY OF S₂,S₁, AND T₁ IN 2,2,7,7-TETRAMETHYL-3,5-CYCLOHEPTADIENONE AND CORRELATIONS WITH INDO CALCULATIONSERIKSEN J; KROGH JESPERSEN K; RATNER MA et al.1975; J. AMER. CHEM. SOC.; U.S.A.; DA. 1975; VOL. 97; NO 19; PP. 5596-5598; BIBL. 31 REF.Article

Potential energy surface of the ¹B_2u excited state in benzene. Mode forms and spectroscopic consequencesKROGH-JESPERSEN, K; RAVA, R. P; GOODMAN, L et al.Journal of physical chemistry (1952). 1984, Vol 88, Num 23, pp 5503-5513, issn 0022-3654Article

MOLECULAR ORBITAL THEORY OF THE ELECTRONIC STRUCTURE OF MOLECULES XXXIX: HIGHLY UNUSUAL STRUCTURES OF ELECTRON-DEFICIENT CARBON COMPOUNDS. REVERSAL OF VAN'T HOFF STEREOCHEMISTRY IN BBC RING SYSTEMSKROGH JESPERSEN K; CREMER D; POPPINGER D et al.1979; J. AMER. CHEM. SOC.; USA; DA. 1979; VOL. 101; NO 17; PP. 4843-4851; BIBL. 37 REF.Article

Kinetics of the competitive 1,2-carbon migrations of an unsymmetrically substituted cyclopropylchlorocarbeneMOSS, R. A; WEIGUO LIU; KROGH-JESPERSEN, K et al.Journal of physical chemistry (1952). 1993, Vol 97, Num 50, pp 13413-13418, issn 0022-3654Article

Computational study of Jahn-Teller type distortions in radical cations of methyl-substituted cyclopropanesKROGH-JESPERSEN, K; ROTH, H. D.Journal of the American Chemical Society. 1992, Vol 114, Num 22, pp 8388-8394, issn 0002-7863Article

ELECTRONIC SPECTRA OF COPPER(II)-IMIDAZOLE AND COPPER(II)-PYRAZOLE CHROMOPHERSBERNARDUCCI E; SCHWINDINGER WF; HUGHEY JL et al.1981; J. AM. CHEM. SOC.; ISSN 0002-7863; USA; DA. 1981; VOL. 103; NO 7; PP. 1686-1691; BIBL. 25 REF.Article

RELATIVE REACTIVITY AND STRUCTURES OF BENZOYLTRIMETHYLHYDRAZINE AND 1-BENZOYL-2-METHYLPYRAZOLIDINEKNAPP S; TOBY BH; SEBASTIAN M et al.1981; J. ORG. CHEM.; ISSN 0022-3263; USA; DA. 1981; VOL. 46; NO 12; PP. 2490-2497; BIBL. 35 REF.Article

AROMATICITY IN SMALL RINGS CONTAINING BORON AND CARBON ((CH)₂ (BH)_N, N=1,2). COMPARISONS WITH ISOELECTRONIC CARBOCATIONS. THE DECISIVE ROLES OF ORBITAL MIXING AND NONBONDED 1,3-INTERACTIONS IN THE STRUCTURES OF FOUR-MEMBERED RINGSKROGH JESPERSEN K; CREMER D; DILL JD et al.1981; J. AM. CHEM. SOC.; ISSN 0002-7863; USA; DA. 1981; VOL. 103; NO 10; PP. 2589-2594; BIBL. 36 REF.Article

Molecular electrostatic potentials and partial atomic charges from correlated wave functions : applications to the electronic ground and excited states of 3-methylindoleWESTBROOK, J. D; LEVY, R. M; KROGH-JESPERSEN, K et al.Journal of computational chemistry. 1992, Vol 13, Num 8, pp 979-989, issn 0192-8651Article

Factors influencing the therdomynamics of H₂ oxidative addition to vaska-type complexes (trans-Ir(Pr₃)₂(CO)X) : predictions from ab initio calculations and experimental verificationFARAJ ABU-HASANAYN; KROGH-JESPERSEN, K; GOLDMAN, A. S et al.Inorganic chemistry (Print). 1993, Vol 32, Num 5, pp 495-496, issn 0020-1669Article

Solvent effects on optical absorption spectra: the ¹A₁→¹A₂ transition of formaldehyde in waterBLAIR, J. T; KROGH-JESPERSEN, K; LEVY, R. M et al.Journal of the American Chemical Society. 1989, Vol 111, Num 18, pp 6948-6956, issn 0002-7863, 9 p.Article