Publications of Hans-Joachim Freund
All genres
Journal Article (766)
Journal Article
H.-J. Freund and : π-electron delocalization in poly(p-phenylene), poly(p-phenylenesulfide), and poly(p-phenyleneoxide). , , , , Physical Review B 28 (4), 1802–1808 (1983).
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H.-J. Freund, , and : Chemisorption of CO on Co(0001). II. Multielectron excitations. Physical Review B 28 (4), 1727–1733 (1983).
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H.-J. Freund: Chemisorption of CO on Co(0001). Structure and electronic properties. , , and Physical Review B 27 (12), 7117–7135 (1983).
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H.-J. Freund and : The T1 State of p-Nitroaniline and Related Molecules: A CNDO/S Study. , Theoretica Chimica Acta 63 (3), 177–194 (1983).
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H.-J. Freund, , and : Influence of Multielectron Excitations on the Band Structure of Adsorbate Overlayers. Physical Review Letters 50 (10), 768–771 (1983).
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H.-J. Freund: Excitation energy dependence in the photoemission satellite structures in solid CO and N2. and The Journal of Chemical Physics 78 (2), 700–707 (1983).
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H.-J. Freund: The core-hole excitation spectrum of benzene: A symmetry-adapted CNDO/S equivalent-core study including "spin-symmetry breaking" configuration. and The Journal of Chemical Physics 77 (11), 5552–5561 (1982).
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H.-J. Freund and : Summary Abstract: Angle‐resolved photoemission study of CO/Co(0001). , , Journal of Vacuum Science and Technology 20 (3), 623–624 (1982).
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H.-J. Freund: Core-hole spectra of D+-Ar-A- molecules in the solid state (D = dialkylamino; A = pyridinium, pyrylium, thiapyrylium). , and Journal of Electron Spectroscopy and Related Phenomena 29 (2), 149–170 (1982).
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H.-J. Freund, , and : An XPS study of intensity borrowing in core ionization of free and coordinated CO. The Journal of Chemical Physics 75 (9), 4275–4284 (1981).
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H.-J. Freund: Intense core-hole satellite structure in aromatic donor/acceptor molecules. , and Chemical Physics Letters 82 (2), 305–310 (1981).
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H.-J. Freund and : Explanation of the satellite structure observed in the photoemission spectra of coordinated CO. Physical Review B 23 (10), 4859–4878 (1981).
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H.-J. Freund and : Shake-up phenomena in D+-Ar-A- structures: A CNDO/S equivalent-core study on N,N-dimethyl-p-nitroaniline in the vapor and condensed phases. Chemical Physics 55 (3), 407–427 (1981).
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H.-J. Freund, and : Summary Abstract: An XPS study of "intensity borrowing" in core ionizations of CO upon coordination to transition metal atoms. Journal of Vacuum Science and Technology 18 (2), 464–465 (1981).
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H.-J. Freund and : Calculation of transition metal compounds using an extension of the CNDO formalism. V. many body effects in the inner valence shell photoionization spectra of free and coordinated carbon monoxide. , Chemical Physics 55 (3), 339–354 (1981).
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H.-J. Freund and : Calculation of Transition Metal Compounds Using an Extension of the CNDO Formalism: VII. Simple Interpretation of Many-body effects in the Core Photoionization of Adsorbates by the Study of CO/Ni and N2/Ni Model Systems. , Surface Science Volume 102 (2–3), 359–378 (1981).
Journal Article
H.-J. Freund, and : Calculation of Transition Metal Compounds Using an Extension of the CNDO-Formalism, II. Metal to Metal Bonding in Binuclear Transition Metal Compounds. Theoretica Chimica Acta 57 (3), 181–207 (1980).
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H.-J. Freund: Temperature-Dependent Ultraviolet Photoemission Linewidths of Molecular Solids: Isopropyl Benzene. , , , and Physical Review Letters 45 (4), 280–283 (1980).
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H.-J. Freund and : Calculation of transition metal compounds using an extension of the CNDO formalism: VI. Simple interpretation of many-body effects in the valence shell photoionization of adsorbates by the study of CO/Ni and N2/Ni model systems. , Surface Science 95 (2-3), 527–554 (1980).
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H.-J. Freund and : Calculation of Transition Metal Compounds Using an Extension of the CNDO Formalism, III. Application to the CO-insertion Reaction as an Example for Mechanistic Studies. , Journal of Organometallic Chemistry 186 (1), 63–75 (1980).