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403 Publikationen

1996 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1628697
V. Thelen, D. Schmidt, M. Nieger, E. Niecke, and W. Schoeller, “Synthesis, structure, and reactivity of a 2,3,4-triphosphapentadienide”, ANGEWANDTE CHEMIE-INTERNATIONAL EDITION IN ENGLISH, 1996, 35, 313-315.
PUB | DOI | WoS
 
1996 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1639471
G. Alcaraz, A. Baceiredo, M. Nieger, W. Schoeller, and G. Bertrand, “X-ray crystal structure, ab initio calculations, and reactivity of 1,3,2 lambda(5)-diazaphosphetes: A new type of 4-pi-electron 4-membered heterocycle”, INORGANIC CHEMISTRY, 1996, 35, 2458-2462.
PUB | DOI | WoS | PubMed | Europe PMC
 
1996 | Konferenzbeitrag | Veröffentlicht | PUB-ID: 1638493
W. Schoeller, J. Strutwolf, and E. Niecke, “Orbital isomerism in the 1.3-diphosphacyclobutane-2.4-diyl, quantum chemical investigations at MCSCF level”, PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS, 1996, 111, 674-674.
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1996 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1639066
W. Schoeller, and U. Tubbesing, “The effect of substituting phosphorus for a ring carbon atom in the valence isomers cyclobutene, bicyclobutane, and 1,3-butadiene. A quantum-chemical investigation”, CHEMISCHE BERICHTE, 1996, 129, 419-425.
PUB | DOI | WoS
 
1996 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1628932
G. Alcaraz, V. Piquet, A. Baceiredo, F. Dahan, W. Schoeller, and G. Bertrand, “Mechanism of the exchange reaction of halodiazirines with nucleophiles revisited. Synthesis of neutral, mono- or dicationic 4-16-membered phosphorus heterocycles”, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1996, 118, 1060-1065.
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1996 | Konferenzbeitrag | Veröffentlicht | PUB-ID: 1638490
W. Schoeller, and J. Strutwolf, “On the electronic structures of metaphosphate PX(3)((-)) and metaphosphite PX(2)((-)) anions, X=CH2,SIH2,NH,PH,O,S”, PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS, 1996, 111, 673-673.
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1996 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1628422
J. Strutwolf, and W. Schoeller, “Linear and cyclic sweep voltammetry at a rotating disk electrode. A digital simulation”, ELECTROANALYSIS, 1996, 8, 1034-1039.
PUB | DOI | WoS
 
1996 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897246
U. Manthe, “A time-dependent discrete variable representation for (multiconfiguration) Hartree methods”, JOURNAL OF CHEMICAL PHYSICS, 1996, 105, 6989-6994.
PUB | DOI | WoS
 
1996 | Konferenzbeitrag | Veröffentlicht | PUB-ID: 1897793
U. Manthe, in Femtochemistry: Ultrafast Chemical and Physical Processes in Molecular Systems (Ed.: C. M.), World Scientific Publishing, Singapore, 1996, p. 90.
PUB
 
1996 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897248
U. Manthe, and F. Matzkies, “Iterative diagonalization within the multi-configurational time-dependent Hartree approach: Calculation of vibrationally excited states and reaction rates”, CHEMICAL PHYSICS LETTERS, 1996, 252, 71-76.
PUB | DOI | WoS
 
1996 | Konferenzbeitrag | Veröffentlicht | PUB-ID: 1638204
W. Schoeller, U. Tubbesing, C. Begeman, and J. Strutwolf, “Cation and anion stabilities of low-coordinated ii-bonded phosphorus systems. An ab initio quantum chemical investigation”, PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS, 1996, 110, 101-104.
PUB | DOI | WoS
 
1996 | Konferenzbeitrag | Veröffentlicht | PUB-ID: 1638209
E. Niecke, P. Becker, A. Fuchs, M. Nieger, T. Schiffer, and W. Schoeller, “Novel aspects in the synthesis of carbenoids containing P/C-p pi-bonds”, PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS, 1996, 110, 613-616.
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1996 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1639122
W. Schoeller, W. Haug, J. Strutwolf, and T. Busch, “The phospha-2-allyl-system: Electrochemical and quantum chemical investigations”, JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS, 1996, 92, 1751-1755.
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1995 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897256
U. Manthe, “Calculation of initial state-selected reaction probabilities by a minimal number of wavepackets”, CHEMICAL PHYSICS LETTERS, 1995, 241, 497-501.
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1995 | Bielefelder E-Dissertation | PUB-ID: 2306251 OA
J. Stiehler, Der numerische Multiconfiguration Self-Consistent Field-Ansatz für Atome, Bielefeld University, Bielefeld (Germany), 01T00:00:00Z.01.1970.
PUB | PDF
 
1995 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1629383
W. Schoeller, and U. TUBBESING, “RELATIVE CATION VERSUS ANION STABILITIES OF LOW-COORDINATED P(III)PI-BONDED PHOSPHORUS-COMPOUNDS”, THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE, 1995, 343, 49-55.
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1995 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1629283
W. Schoeller, B. GOETTE, and U. TUBBESING, “ELECTRONIC-STRUCTURE OF THE 1,3-DIPHOSPHETANE”, JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 1995, 8, 742-746.
PUB | DOI | WoS
 
1995 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1641265
W. Schoeller, “ON BONDING IN THE TETRAPHOSPHABICYCLO[3.3.0]OCTA-1,4-DIENE-1,4-DIOLATE DILITHIUM STRUCTURE”, THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE, 1995, 332, 225-229.
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1995 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1641557
W. Schoeller, J. STRUTWOLF, U. TUBBESING, and C. BEGEMANN, “HALOGEN SUBSTITUTION AT PHOSPHORUS IN PHOSPHAALKENES AND PHOSPHASILENES VERSUS BIS(METHYLENE)PHOSPHORANES - A QUANTUM-CHEMICAL EVALUATION OF BONDING PROPERTIES”, JOURNAL OF PHYSICAL CHEMISTRY, 1995, 99, 2329-2334.
PUB | DOI | WoS
 
1995 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1640051
E. NIECKE, P. BECKER, M. NIEGER, D. STALKE, and W. Schoeller, “CARBENOID OR LITHIUM COMPLEX OF A CARBANION - SYNTHESIS AND STRUCTURE OF (ME(3)SI)(2)C=P(ARYL)=C(CL)LI(THF)(3) AND LICL ELIMINATION TO GIVE THE PHOSPHIRENE”, ANGEWANDTE CHEMIE-INTERNATIONAL EDITION, 1995, 34, 1849-1852.
PUB | DOI | WoS
 
1995 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1641357
E. NIECKE, A. FUCHS, F. BAUMEISTER, M. NIEGER, and W. Schoeller, “A P2C2 4-MEMBERED RING WITH UNUSUAL BONDING - SYNTHESIS, STRUCTURE, AND RING-OPENING OF A 1,3-DIPHOSPHACYCLOBUTANE-2,4-DIYL”, ANGEWANDTE CHEMIE-INTERNATIONAL EDITION IN ENGLISH, 1995, 34, 555-557.
PUB | DOI | WoS
 
1995 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897258
U. Manthe, “A new time-dependent approach to the direct calculation of reaction rates”, JOURNAL OF CHEMICAL PHYSICS, 1995, 102, 9205-9213.
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1995 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1640583
W. Schoeller, “VINYLIDENECARBENOID - THE IMPORTANCE OF SOLVATION AND ELECTRON CORRELATION-EFFECTS ON ITS STRUCTURE”, CHEMICAL PHYSICS LETTERS, 1995, 241, 21-25.
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1995 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1641125
W. Schoeller, J. STRUTWOLF, and E. NIECKE, “ON THE ELECTRONIC-STRUCTURES OF THE METAPHOSPHATE (METAPHOSPHITE) ANIONS PX(3)((-))(PX(2)((-))), X=CH2, SIH2, NH, PH, O, S”, THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE, 1995, 333, 249-260.
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1994 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897275
U. Manthe, “Comment on: A multiconfiguration time-dependent Hartree approximation based on natural single particle states”, JOURNAL OF CHEMICAL PHYSICS, 1994, 101, 2652-2653.
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1994 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1641856
C. GALLIOT, A. M. CAMINADE, F. DAHAN, J. P. MAJORAL, and W. Schoeller, “PHOSPHORUS-CONTAINING N-METHYLENEAMINE TYPE COMPOUNDS - SYNTHESIS, STRUCTURE, AND REACTIVITY”, INORGANIC CHEMISTRY, 1994, 33, 6351-6356.
PUB | DOI | WoS
 
1994 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1642373
W. Schoeller, and T. BUSCH, “ON THE ELECTRONIC-STRUCTURE OF THE CATIONS, RADICALS AND ANIONS OF H2SIP, H2PSI AND RELATED-COMPOUNDS”, JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1994, 119, 27-40.
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1994 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1644234
G. DAVID, E. NIECKE, M. NIEGER, J. RADSECK, and W. Schoeller, “DONOR STABILIZATION, TRANSFER-REACTIONS, AND BONDING PROPERTIES OF A METHYLENEDIYLPHOSPHENIUM ION”, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1994, 116, 2191-2192.
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1994 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1643798
W. Schoeller, and T. BUSCH, “ELECTRONIC-STRUCTURE OF THE DISILENYL RADICAL-ANION”, JOURNAL OF PHYSICAL ORGANIC CHEMISTRY, 1994, 7, 251-255.
PUB | DOI | WoS
 
1994 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1644135
W. Schoeller, and J. STRUTWOLF, “ON THE ELECTRONIC HYPERSURFACE OF THE METHYLENEPHOSPHENIUM CATION”, THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE, 1994, 111, 127-137.
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1994 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1642571
G. DAVID, V. VONDERGONNA, E. NIECKE, T. BUSCH, W. Schoeller, and P. RADEMACHER, “SPECTROSCOPIC INVESTIGATIONS ON IMINOPHOSPHANES AND METHYLENEPHOSPHANES”, JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS, 1994, 90, 2611-2616.
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1994 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1643036
D. GUDAT, W. HOFFBAUER, E. NIECKE, W. Schoeller, U. FLEISCHER, and W. KUTZELNIGG, “P-31 SOLID-STATE NMR-STUDY OF IMINOPHOSPHINES - INFLUENCE OF ELECTRONIC-STRUCTURE AND CONFIGURATION OF THE DOUBLE-BOND ON PHOSPHORUS SHIELDING”, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1994, 116, 7325-7331.
PUB | DOI | WoS
 
1994 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897260
A. Vef, U. Manthe, P. Gütlich, and A. Hauser, “Intersystem crossing dynamics in the spin-crossover systems [M:Fe(pic)3]Cl2.Sol (M=Mn or Zn, Sol=MeOH or EtOH)”, JOURNAL OF CHEMICAL PHYSICS, 1994, 101, 9326-9332.
PUB | DOI | WoS
 
1994 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897265
A. D. Hammerich, U. Manthe, R. Kosloff, H. D. Meyer, and L. S. Cederbaum, “Time-dependent photodissociation of methyl iodide with five active modes”, JOURNAL OF CHEMICAL PHYSICS, 1994, 101, 5623-5646.
PUB | DOI | WoS
 
1994 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1642096
E. NIECKE, M. FROST, M. NIEGER, V. VONDERGONNA, A. RUBAN, and W. Schoeller, “MONOMERIC TRIS(IMINO)METAPHOSPHATES”, ANGEWANDTE CHEMIE-INTERNATIONAL EDITION IN ENGLISH, 1994, 33, 2111-2113.
PUB | DOI | WoS
 
1994 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897271
U. Manthe, T. Seideman, and W. H. Miller, “Quantum mechanical calculations of the rate constant for the HO+H2-> H2O+H reaction: full-dimensional results and comparision to reduced dimensionality models”, JOURNAL OF CHEMICAL PHYSICS, 1994, 101, 4759-4768.
PUB | DOI | WoS
 
1993 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1645358
W. Schoeller, “SMALL RING CYCLOPHOSPHENES - A THEORETICAL EVALUATION OF BONDING PROPERTIES”, THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE, 1993, 103, 61-66.
PUB | WoS
 
1993 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1645864
W. Schoeller, and T. BUSCH, “AZA-SUBSTITUTION VERSUS PHOSPHA-SUBSTITUTION IN CYCLOBUTADIENE - A THEORETICAL EVALUATION OF BONDING PROPERTIES”, ANGEWANDTE CHEMIE-INTERNATIONAL EDITION IN ENGLISH, 1993, 32, 617-619.
PUB | DOI | WoS
 
1993 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1646420
E. NIECKE, R. DETSCH, M. NIEGER, F. REICHERT, and W. Schoeller, “FROM COVALENT TO IONIC BONDING - SPONTANEOUS BOND-DISSOCIATION IN OXY-SUBSTITUTED IMINOPHOSPHANES”, BULLETIN DE LA SOCIETE CHIMIQUE DE FRANCE, 1993, 130, 25-31.
PUB | WoS
 
1993 | Konferenzbeitrag | Veröffentlicht | PUB-ID: 1645157
W. Schoeller, T. BUSCH, W. HAUG, and J. STRUTWOLF, “PHOSPHORUS IN STRAINED RING-SYSTEMS”, PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS, 1993, 77, 645-648.
PUB | WoS
 
1993 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1645486
G. DAVID, E. NIECKE, M. NIEGER, V. VONDERGONNA, and W. Schoeller, “[N+2]-CYCLOADDITION REACTIONS OF THE (ARYLIMINO)PHOSPHENIUM ION, [PNAR]+ - KATIONIC PN HETEROCYCLES WITH UNUSUAL STRUCTURE AND BONDING SITUATION”, CHEMISCHE BERICHTE-RECUEIL, 1993, 126, 1513-1517.
PUB | DOI | WoS
 
1993 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897277
U. Manthe, T. Seideman, and W. H. Miller, “Full-dimensional quantum calculations of the rate constant for the HO+H2 -> H2O+H reaction”, JOURNAL OF CHEMICAL PHYSICS, 1993, 99, 10078-10081.
PUB | DOI | WoS
 
1993 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897284
U. Manthe, and A. D. Hammerich, “Wavepacket Dynamics in Five Dimensions: Photodissociation of Methyl Iodide”, CHEMICAL PHYSICS LETTERS, 1993, 211, 7-14.
PUB | DOI | WoS
 
1993 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1646980
W. Schoeller, J. STRUTWOLF, W. HAUG, and T. BUSCH, “ROTATIONAL BARRIER IN PHOSPHATRIAFULVENE - AN MCSCF STUDY”, JOURNAL OF COMPUTATIONAL CHEMISTRY, 1993, 14, 3-7.
PUB | DOI | WoS
 
1993 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1644939
W. Schoeller, W. HAUG, and J. STRUTWOLF, “ON THE ELECTRONIC HYPERSURFACE OF THE PHOSPHIRANYL CATION - A THEORETICAL-STUDY”, BULLETIN DE LA SOCIETE CHIMIQUE DE FRANCE, 1993, 130, 636-641.
PUB | WoS
 
1993 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897281
U. Manthe, and W. H. Miller, “The Cumulative Reaction Probability as Eigenvalue Problem”, JOURNAL OF CHEMICAL PHYSICS, 1993, 99, 3411-3419.
PUB | DOI | WoS
 
1992 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897287
U. Manthe, H. D. Meyer, and L. S. Cederbaum, “Multiconfigurational time-dependent Hartree study of complex dynamics: Photodissociation of NO2”, JOURNAL OF CHEMICAL PHYSICS, 1992, 97, 9062-9071.
PUB | DOI | WoS
 
1992 | Sammelwerksbeitrag | Veröffentlicht | PUB-ID: 1897838
M. H.-D., U. Manthe, K. J., and C. L. S., in Time-dependent Quantum Molecular Dynamics (Eds.: B. J., L. L.), Plenum Press, New York, 1992, p. 223.
PUB
 
1992 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1647965
R. DETSCH, E. NIECKE, M. NIEGER, and W. Schoeller, “MONOMER AND DIMER 1,3-DIAZA-2-PHOSPHAALLYLLITHIUM COMPLEXES - STRUCTURES AND AMBIDENT REACTIVITY”, CHEMISCHE BERICHTE-RECUEIL, 1992, 125, 1119-1124.
PUB | DOI | WoS
 
1992 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1647877
W. Schoeller, and T. BUSCH, “BIS(METHYLENE)PHOSPHORANE AND RELATED-COMPOUNDS - ELECTROCYCLIZATION TO RING-SYSTEMS”, CHEMISCHE BERICHTE-RECUEIL, 1992, 125, 1319-1323.
PUB | DOI | WoS
 
1992 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897291
U. Manthe, H. D. Meyer, and L. S. Cederbaum, “Wave-packet dynamics within the multiconfigurational Hartree framework: General aspects and application to NOCl”, JOURNAL OF CHEMICAL PHYSICS, 1992, 97, 3199-3213.
PUB | DOI | WoS
 
1992 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1647154
T. BUSCH, and W. Schoeller, “BRIDGING IN P2R CATIONS”, CHEMICAL PHYSICS LETTERS, 1992, 200, 26-34.
PUB | DOI | WoS
 
1992 | Sammelwerksbeitrag | Veröffentlicht | PUB-ID: 1897846
K. H., and U. Manthe, in Time-dependent Quantum Molecular Dynamics (Eds.: B. J., L. L.), Plenum Press, New York, 1992, p. 83.
PUB
 
1991 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897299
U. Manthe, and H. Köppel, “Three-dimensional wave-packet dynamics on vibronically coupled dissociative potential energy surfaces”, CHEMICAL PHYSICS LETTERS, 1991, 178, 36-42.
PUB | DOI | WoS
 
1991 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1649855
W. Schoeller, and T. BUSCH, “SUBSTITUENT EFFECTS ON FOLDING IN CYCLOTETRAPHOSPHANE”, CHEMISCHE BERICHTE, 1991, 124, 1369-1371.
PUB | DOI | WoS
 
1991 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1650167
W. Schoeller, J. NIEMANN, R. THIELE, and W. HAUG, “ELECTROCHEMICAL INVESTIGATIONS ON METHYLENEPHOSPHINES AND RELATED SYSTEMS”, CHEMISCHE BERICHTE, 1991, 124, 417-421.
PUB | DOI | WoS
 
1991 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1629803
E. FUCHS, B. BREIT, H. HEYDT, W. Schoeller, T. BUSCH, C. KRUGER, P. BETZ, and M. REGITZ, “ORGANOPHOSPHORUS COMPOUNDS .51. PHOSPHATRIAFULVENES - PHOSPHAALKENES WITH INVERSE ELECTRON-DENSITY”, CHEMISCHE BERICHTE-RECUEIL, 1991, 124, 2843-2855.
PUB | DOI | WoS
 
1991 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1649671
J. NIEMANN, W. Schoeller, V. VONDERGONNA, and E. NIECKE, “REDOX PROPERTIES OF DIPHOSPHANES”, CHEMISCHE BERICHTE, 1991, 124, 1563-1565.
PUB | DOI | WoS
 
1991 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1650298
W. Schoeller, U. WELZ, W. HAUG, and T. BUSCH, “ON THE ELECTRONIC-STRUCTURE OF PHOSPHABUTATRIENE AND RELATED PHOSPHACUMULENES - A THEORETICAL-STUDY”, CHEMISCHE BERICHTE, 1991, 124, 271-274.
PUB | DOI | WoS
 
1991 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897295
U. Manthe, H. Köppel, and L. S. Cederbaum, “Dissociation and predissociation on coupled electronic potential energy surfaces: A three-dimensional wave packet dynamical study”, JOURNAL OF CHEMICAL PHYSICS, 1991, 95, 1708-1720.
PUB | DOI | WoS
 
1990 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 2357066
D. Anselmetti, V. GEISER, D. BRODBECK, G. OVERNEY, R. WIESENDANGER, and H. J. GÜNTHERODT, “HEXAGONAL AND NONHEXAGONAL SUPERLATTICE STRUCTURES ON STAGE-1 ALKALI-METAL GRAPHITE-INTERCALATION COMPOUNDS STUDIED BY SCANNING TUNNELING MICROSCOPY”, Synthetic Metals, 1990, 38, 157-167.
PUB | DOI | WoS
 
1990 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897302
H. Spiering, M. Alflen, P. Gütlich, A. Hauser, C. Hennen, U. Manthe, and F. Tuzek, “Advances in Mössbauer Emission-Spectroscopy”, HYPERFINE INTERACTIONS, 1990, 53, 113-141.
PUB
 
1990 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1651021
W. Schoeller, T. BUSCH, and E. NIECKE, “SIGMA-PUSH-PULL SUBSTITUTION IN IMINOPHOSPHANES, A THEORETICAL-STUDY”, CHEMISCHE BERICHTE, 1990, 123, 1653-1654.
PUB | DOI | WoS
 
1990 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1651492
W. Schoeller, and T. BUSCH, “DIPHOSPHINONITRENIUM AND DIPHOSPHENIUM CATIONS, JAHN-TELLER DISTORTED ALLYL SYSTEMS”, CHEMISCHE BERICHTE, 1990, 123, 971-973.
PUB | DOI | WoS
 
1990 | Konferenzbeitrag | Veröffentlicht | PUB-ID: 1651275
W. Schoeller, T. BUSCH, and W. HAUG, “SUBSTITUENT EFFECTS ON GEOMETRIES OF IMINOPHOSPHANES AND DISPHOSPHENES - THE EFFECT OF SIGMA-PUSH-PULL SUBSTITUTION”, PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS, 1990, 49, 285-288.
PUB | DOI | WoS
 
1990 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897316
H. D. Meyer, U. Manthe, and L. S. Cederbaum, “The multi-configurational time-dependent Hartree approach”, CHEMICAL PHYSICS LETTERS, 1990, 165, 73-78.
PUB | DOI | WoS
 
1990 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897310
U. Manthe, and H. Köppel, “Dynamics on potential energy surfaces with a conical intersection: Adiabatic, intermediate, and diabatic behavior”, JOURNAL OF CHEMICAL PHYSICS, 1990, 93, 1658-1669.
PUB | DOI | WoS
 
1990 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1897313
U. Manthe, and H. Köppel, “New method for calculating wave packet dynamics: Strongly coupled surfaces and the adiabatic basis”, JOURNAL OF CHEMICAL PHYSICS, 1990, 93, 345-356.
PUB | DOI | WoS
 
1989 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1652560
T. BUSCH, and W. Schoeller, “CYCLIC AND LINEAR ANALOGS OF N2O - THEORETICAL EVALUATION OF BONDING PROPERTIES”, ZEITSCHRIFT FUR PHYSIK D-ATOMS MOLECULES AND CLUSTERS, 1989, 13, 289-294.
PUB | DOI | WoS
 
1989 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1652173
W. Schoeller, and J. NIEMANN, “BONDING IN THE TRISMETHYLENEMETAPHOSPHATE ANION AND RELATED-COMPOUNDS - PYRAMIDALIZATION AT PHOSPHORUS, THEORETICAL AND EXPERIMENTAL INVESTIGATIONS”, PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS, 1989, 46, 47-59.
PUB | WoS
 
1989 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1652276
T. BUSCH, W. Schoeller, E. NIECKE, M. NIEGER, and H. WESTERMANN, “UNUSUAL BONDING IN A MAIN-GROUP MULTIPLE-BONDED SYSTEM - UMBRELLA-SHAPED DIPHOSPHENES”, INORGANIC CHEMISTRY, 1989, 28, 4334-4340.
PUB | DOI | WoS
 
1989 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1652689
W. GUTH, T. BUSCH, W. Schoeller, E. NIECKE, B. KREBS, M. DARTMANN, and P. RADEMACHER, “A CYCLIC 1.2-DIPHOSPHA-1.3-DIENE - SYNTHESIS, CRYSTAL-STRUCTURE AND BONDING PROPERTIES”, NEW JOURNAL OF CHEMISTRY, 1989, 13, 309-313.
PUB | WoS
 
1989 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1653230
W. Schoeller, and T. BUSCH, “BIS-SILANEDIYLPHOSPHORANE VERSUS BIS-METHYLENEPHOSPHORANE - A THEORETICAL-STUDY”, JOURNAL OF THE CHEMICAL SOCIETY-CHEMICAL COMMUNICATIONS, 1989, 234-236.
PUB | DOI | WoS
 
1989 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1652383
E. P. O. FUCHS, H. HEYDT, M. REGITZ, W. Schoeller, and T. BUSCH, “UNUSUALLY COORDINATED PHOSPHORUS-COMPOUNDS .39. PHOSPHATRIAFULVENES - PHOSPHAALKENES WITH INVERSE ELECTRON-DENSITY”, TETRAHEDRON LETTERS, 1989, 30, 5111-5114.
PUB | DOI | WoS
 
1988 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1653666
W. Knoche, W. Schoeller, R. SCHOMACKER, and S. VOGEL, “PROTONATION OF 1,3,5-TRIAMINOBENZENES IN AQUEOUS-SOLUTIONS - THERMODYNAMICS AND KINETICS OF THE FORMATION OF STABLE SIGMA-COMPLEXES”, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1988, 110, 7484-7489.
PUB | DOI | WoS
 
1988 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1654457
W. Schoeller, J. NIEMANN, and P. RADEMACHER, “ON THE ELECTROCHEMICAL OXIDATION OF ENAMINES”, JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1988, 369-373.
PUB | DOI | WoS
 
1988 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1653372
E. NIECKE, M. NIEGER, F. REICHERT, and W. Schoeller, “SYNTHESIS, STRUCTURE AND BONDING IN THE DONOR-ACCEPTOR COMPLEX [TERTBU2PSE2].[PNARYL] - EN ROUTE TO THE P=N BOND”, ANGEWANDTE CHEMIE-INTERNATIONAL EDITION IN ENGLISH, 1988, 27, 1713-1714.
PUB | DOI | WoS
 
1987 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1655310
W. Schoeller, and J. NIEMANN, “ON THE POTENTIAL HYPERSURFACE OF THE DICATION OF CYCLOTETRAPHOSPHANE”, THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE, 1987, 37, 145-154.
PUB | WoS
 
1987 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1655651
W. Schoeller, and T. DABISCH, “BONDING IN CYCLOSILANES - EFFECT OF ORBITAL NONHYBRIDIZATION”, INORGANIC CHEMISTRY, 1987, 26, 1081-1086.
PUB | DOI | WoS
 
1987 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1655568
C. LERCH, J. NIEMANN, and W. Schoeller, “BISMETHYLENEPHOSPHORANE AND TRISMETHYLENEPHOSPHORANE - EXPERIMENTAL AND THEORETICAL EVALUATION OF BONDING PROPERTIES”, PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS, 1987, 30, 503-506.
PUB | DOI | WoS
 
1987 | Kurzbeitrag Konferenz / Poster | Veröffentlicht | PUB-ID: 1655587
J. NIEMANN, and W. Schoeller, “ON THE REDOX PROPERTIES OF CYCLOPHOSPHANES”, PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS, 1987, 30, 803-803.
PUB | DOI | WoS
 
1987 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1654656
W. Schoeller, T. DABISCH, and T. BUSCH, “BOND STRETCH ISOMERISM IN THE SILICON ANALOGS OF BICYCLO[1.1.0]BUTANE AND OF [1.1.1]PROPELLANE - CONSEQUENCE OF ORBITAL NONHYBRIDIZATION”, INORGANIC CHEMISTRY, 1987, 26, 4383-4389.
PUB | DOI | WoS
 
1986 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1657006
W. Schoeller, and C. LERCH, “DICOORDINATION AND TRICOORDINATION AT PHOSPHORUS - ABINITIO STUDY OF BONDING IN BIS(IMINO)PHOSPHORANES AND RELATED-COMPOUNDS”, INORGANIC CHEMISTRY, 1986, 25, 576-580.
PUB | DOI | WoS
 
1986 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1656091
H. G. SCHAFER, W. Schoeller, J. NIEMANN, W. HAUG, T. DABISCH, and E. NIECKE, “ON THE REDOX PROPERTIES OF CYCLOTETRAPHOSPHANES - A NOVEL DICATION REARRANGEMENT”, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1986, 108, 7481-7484.
PUB | DOI | WoS | PubMed | Europe PMC
 
1986 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1657199
W. Schoeller, and J. NIEMANN, “SOME ASPECTS OF THE ELECTRONIC HYPERSURFACE OF BIS(METHYLENE)PHOSPHORANE - AN EXPERIMENTAL AND THEORETICAL APPROACH”, JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1986, 108, 22-26.
PUB | DOI | WoS
 
1986 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1656529
U. DRESSLER, E. NIECKE, S. POHL, W. SAAK, W. Schoeller, and H. G. SCHAFER, “1-AMINODIAZAPHOSPHENE, SYNTHESIS, CRYSTAL-STRUCTURE, BONDING PROPERTIES, AND REACTIVITY OF A DERIVATIVE”, JOURNAL OF THE CHEMICAL SOCIETY-CHEMICAL COMMUNICATIONS, 1986, 1086-1087.
PUB | DOI | WoS
 
1986 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1656593
T. DABISCH, and W. Schoeller, “UNUSUAL BONDING IN BICYCLOTETRASILANE VS BICYCLOBUTANE - A THEORETICAL-STUDY”, JOURNAL OF THE CHEMICAL SOCIETY-CHEMICAL COMMUNICATIONS, 1986, 896-898.
PUB | DOI | WoS
 
1986 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1656125
W. Schoeller, V. STAEMMLER, P. RADEMACHER, and E. NIECKE, “THEORETICAL-STUDIES ON INORGANIC RING-SYSTEMS - TETRAPHOSPHABICYCLOBUTANE, CYCLOTRIPHOSPHANE, AND WHITE PHOSPHORUS - RING STRAIN AND HYBRIDIZATION”, INORGANIC CHEMISTRY, 1986, 25, 4382-4385.
PUB | DOI | WoS
 
1986 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1656711
S. VOGEL, W. Knoche, and W. Schoeller, “PROTONATION OF 1,3,5-TRIPYRROLIDINOBENZENE IN BASIC AQUEOUS-SOLUTION - THERMODYNAMICS AND KINETICS OF THE FORMATION OF A STABLE SIGMA-COMPLEX”, JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1986, 769-772.
PUB | DOI | WoS
 
1986 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1656648
W. Schoeller, “THEORETICAL ASPECTS OF THE INVERSION BARRIERS IN CYCLOTRIPHOSPHANES AND RELATED SYSTEMS”, THEOCHEM-JOURNAL OF MOLECULAR STRUCTURE, 1986, 30, 341-345.
PUB | WoS
 
1985 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1657656
E. NIECKE, D. GUDAT, W. Schoeller, and P. RADEMACHER, “PHOSPHORUS(III) DOUBLE-BOND SYSTEMS, CARBENE AND ALKENE ANALOGS - THE ELECTRONIC-STRUCTURE OF IMINO-PHOSPHANES AND METHYLENE-PHOSPHANES”, JOURNAL OF THE CHEMICAL SOCIETY-CHEMICAL COMMUNICATIONS, 1985, 1050-1051.
PUB | DOI | WoS
 
1985 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1657285
W. Schoeller, and T. DABISCH, “ANOMALY IN THE RING STRAIN BEHAVIOR OF CYCLOPROPANE, CYCLOBUTANE, AND CYCLOPENTANE, COMPARED WITH THEIR SILICON ANALOGS - A THEORETICAL-STUDY”, JOURNAL OF THE CHEMICAL SOCIETY-CHEMICAL COMMUNICATIONS, 1985, 1706-1707.
PUB | DOI | WoS
 
1985 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1657534
W. Schoeller, “BONDING IN THE P(PH3)2 AND N(PH3)2 CATIONS - AN ABINITIO STUDY”, ZEITSCHRIFT FUR NATURFORSCHUNG SECTION B-A JOURNAL OF CHEMICAL SCIENCES, 1985, 40, 1149-1151.
PUB | WoS
 
1985 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1658114
W. Schoeller, “THE (4+2) CYCLO-ADDITION PROPERTIES OF HETEROATOM DOUBLE-BOND SYSTEMS - A FRONTIER ORBITAL APPROACH TO REACTIVITY”, JOURNAL OF THE CHEMICAL SOCIETY-CHEMICAL COMMUNICATIONS, 1985, 334-335.
PUB | DOI | WoS
 
1984 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1658278
W. Schoeller, “ON THE CIRCUMAMBULATORY REARRANGEMENT OF CYCLOPENTADIENYLPHOSPHANES - RETENTION VERSUS INVERSION AT THE MIGRATION PHOSPHORUS”, ZEITSCHRIFT FUR NATURFORSCHUNG SECTION B-A JOURNAL OF CHEMICAL SCIENCES, 1984, 39, 1767-1771.
PUB | WoS
 
1984 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1658511
W. Schoeller, “THE 1,5-SIGMATROPIC SHIFT OF A BR2 UNIT (R = H, F, OH, NH2, CL, OR SH) OVER A CYCLOPENTADIENE SYSTEM”, JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS, 1984, 2233-2236.
PUB | DOI | WoS
 
1984 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1658551
W. Schoeller, and V. STAEMMLER, “SUBSTITUENT EFFECTS ON BONDING PROPERTIES IN DIPHOSPHENES, DISILENES, AND DIIMINES”, INORGANIC CHEMISTRY, 1984, 23, 3369-3373.
PUB | DOI | WoS
 
1983 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1659307
W. Schoeller, “ON THE WALK REARRANGEMENT OF CYCLOPENTADIENYLPHOSPHANES AND RELATED-COMPOUNDS - A MOLECULAR-ORBITAL STUDY”, ZEITSCHRIFT FUR NATURFORSCHUNG SECTION B-A JOURNAL OF CHEMICAL SCIENCES, 1983, 38, 1635-1642.
PUB | DOI | WoS
 
1983 | Kurzbeitrag Konferenz / Poster | Veröffentlicht | PUB-ID: 1659182
W. Schoeller, and C. LERCH, “ON THE ELECTRONIC-STRUCTURE OF BICYCLOTETRAPHOSPHABUTANE”, PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS, 1983, 18, 450.
PUB | WoS
 
1983 | Zeitschriftenaufsatz | Veröffentlicht | PUB-ID: 1659447
W. Schoeller, and T. DABISCH, “SUBSTITUENT EFFECTS ON THE BONDING PROPERTIES IN CYCLOTRIPHOSPHANES AND RELATED-COMPOUNDS - POLARIZATION OF HUCKEL VERSUS MOBIUS ORBITALS”, JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS, 1983, 2411-2413.
PUB | DOI | WoS
 

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