Publications
Quickly jump to the following years directly: 1989, 1988, 1987, 1986, 1985, 1984, 1983, 1982, 1981, 1980
Theoretical Biochemistry Group
Institute for Theoretical Chemistry
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1989
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89-001 P.Schuster. Optimization and Complexity in Molecular Biology and Physics. In: P.Plath, ed. Optimal Structures in Heterogeneous Reaction Systems. Springer, Series in Synergetics Springer pp.101-122, 1989 |
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89-002 M.Eigen, J.McCaskill, and P.Schuster. The Molecular Quasispecies. Adv.Chem.Phys. 75: 149-263, 1989 |
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89-003 J.Reiter, A.Beyer, M.Potschka, P.Schuster, H.Winkler, H.Ebeling, and E.U.Franck. Proton-Transfer Reactions of Dibasic Acids in Aqueous Solution: 3-Hydroxypyridine and Anthranilic Acid. J.Phys.Chem. 93: 442-451, 1989 |
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89-004 M.Nowak, P.Schuster. Error Thresholds of Replication in Finite Populations. J.Theor.Biol. 137: 375-395, 1989 |
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89-005 P.Schuster, and K.Sigmund. Fixation Probabilites for Advantageous Mutants: A Note on Multiplication and Sampling. Math.Biosciences 95: 37-51, 1989 |
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89-006 W.Fontana, W.Schnabl, and P.Schuster. Physical Aspects of Evolutionary Optimization and Adaptation. Phys.Rev. A40 3301-3321, 1989 |
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89-007 P.Schuster. Origins of Information and Complexity in Biology. In: P.Weingartner, and G.Schurz, eds. Philosophy of the Natural Sciences, Proceedings of the 13th Int.Wittgenstein Symposium, Kirchberg/Wechsel, Austria 1988. Hölder-Pichler-Tempsky, pp.273-283, Wien 1989 |
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89-008 P.R.Bunker, T.Carrington,Jr., P.C.Gomez, M.D.Marshall, M.Kofranek, H.Lischka, and A.Karpfen. An Ab Initio Semirigid Bender Calculation of the Rotation and Trans-tunneling Spectra of (HF)2 and (DF)2. J.Chem.Phys. 91: 5154-5159, 1989 |
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89-009 P.R.Bunker, P.Jensen, A.Karpfen, and H.Lischka. A Theoretical Calculation of the Rotation-Vibration Energies for Lithium Hydroxide, LiOH. J.Mol.Spect. 135: 89-104, 1989 |
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89-010 P.G.Szalay, H.Lischka, and A.Karpfen. Relative Stabilities of the s-Cis and Gauche Structures of 1,3-Butadiene. J.Phys.Chem. 93: 6629-6631, 1989 |
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89-011 P.G.Szalay, A.Karpfen, and H.Lischka. Geometry Relaxation Effects in the 11Bu and 21Ag States of Trans-1,3-Butadiene. Chem.Phys. 130: 219-228, 1989 |
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89-012 J.N.L.Connor, and W.Jakubetz. Dynamics of the Light Atom Transfer Reaction: Cl+HCl -> ClH+Cl. In: A.Lagana, ed. Supercomputer Algorithms for Reactivity, Dynamics and Kinetics of Small Molecules. Kluwer, pp.395-414, Dordrecht 1989 |
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89-013 W.Jakubetz, J.Manz, and V.Mohan. Model Preparation of H2O Hyperspherical Modes by Visible versus Infrared Multiphoton Excitation. J.Chem.Phys. 90: 3686-3699, 1989 |
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89-014 M.Hoffmann-Ostenhof, and T.Hoffmann-Ostenhof. Asymptotic Properties of Nodes of Solutions to Schrödinger Equations. In: H.Kurke, J.Mecke, R.Thiele, H.Triebel, G.Wechsung, eds. Teubner-Texte zur Mathematik, Bd.112 Teubner Verlagsgesellschaft, pp.157-162, Leipzig 1989 |
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89-015 A.Beyer, P.Wolschann, A.Becker, and G.Buchbauer. The Use of Constraints in Molecular Mechanics Calculations of Medium-Sized Molecules. J.Mol.Structure 196: 371-373, 1989 |
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89-016 S.M.Ansari, W.Robien, M.Schlederer, and P.Wolschann. 1H-NMR Inverstigations of the Conformation of Aryl-(hydroxynaphthyl)-methylpirimidines (Intramolecular Interactions IV.). Mh.Chem. 120 1003-1014, 1989 |
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89-017 A.Becker, G.Buchbauer, S.Winiwarter, A.Beyer, and P.Wolschann. Computer Modelling of Structure Activity Relationship in Sandalwood Odour Molecules. In: S.C.Bhattacharyya, N.Sen, K.L.Sethi, eds. 11th International Congress of Essential Oils, Fragrances and Flavoures, New Delhi 1969, Oxford and IBH Publishing, pp.1-10, New Delhi 1989 |
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89-018 P.Schuster. Spontane Ordnungsentstehung in Chemie und Biologie. In: O.Molden, ed. Europäisches Forum Alpbach 1989 Österr.College, pp.81-85, Wien 1989 |
1988
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88-001 P.Schuster. Potential Functions in Molecular Evolution. In: M.G.Velarde, ed. Synergetics, Order and Chaos. World Scientific Publishing, pp.382-410, Singapore 1988 |
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88-002 P.Schuster. Potential Functions and Molecular Evolution. In: M.Markus, S.C.Müller, and G.Nicolis, eds. From Chemical to Biological Organization. Springer Series in Synergetics Vol.39. Springer, pp.149-165, Berlin 1988 |
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88-003 P.Schuster. Evolution von Molekülen und einfachen Viren. In: B.Wilhelmi, ed. Theoretische Grundlagen und Probleme der Biologie, pp.55-81, Univ.Jena 1988 |
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88-004 J.Reiter, P.Schuster, H.Winkler, and F.Eggers. Proton Transfer Reactions in Aqueous Solutions of Pyridoxamine Phosphate. Eur.Biophys.J. 16: 219-229, 1988 |
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88-005 P.Schuster, and J.Swetina. Stationary Mutant Distribution and Evolutionary Optimization. Bull.Math.Biol. 50: 635-660, 1988 |
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88-006 M.Eigen, J.McCaskill, and P.Schuster. The Molecular Quasispecies - An Abridged Account. J.Phys.Chem. 92: 6881-6891, 1988 |
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88-006 P.R.Bunker, M.Kofranek, H.Lischka, and A.Karpfen. An Analytical Six-dimensional Potential Energy Surface for (HF)2 from Ab Initio Calculations. J.Chem.Phys. 89: 3002-3007, 1988 |
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88-007 M.Kofranek, H.Lischka, and A.Karpfen. Coupled Pair Functional Study on the Hydrogen Fluoride Dimer. I.Energy Surface and Characterization of Stationary Points. Chem.Phys. 121: 137-153, 1988 |
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88-008 M.Nonella, T.-K.Ha, H.Lischka, and J.R.Huber. The Electric Dipole Moments of Propynal in the Electronic States S0, S1 and T1. An Ab Initio Calculation. Chem.Phys.Lett. 144: 445-449, 1988 |
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88-009 O.Steinhauser, and I.Hausleithner. The Binary System Benzene-Hexafluorobenzene Studied by SSOZ Theory and Computer Simulation. II. The Structure of the Pure Components. Ber.Bunsenges.Phys.Chem. 92: 781-792, 1988 |
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88-010 J.N.L.Connor, and W.Jakubetz. Investigation of the Orientation Dependence of the F+H2 Reaction Using Scaled Barrier Functions in the Angle-Dependent Line-of-Centres Model. In: J.C.Whitehead, ed. Selectivity in Chemical Reactions. Reidel, pp.322-339, Dordrecht 1988 |
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88-011 S.-K.Rhee, and A.Karpfen. Ab Initio Studies on Hydrogen-Bonded Clusters. II. Structures and Vibrational Spectra of the Hydrogen-Bonded Trimers (HCN)2HF, (HCN)2HCl, (NCH)2OH2 and (NCH)2NH3. Chem.Phys. 120: 199-213, 1988 |
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88-012 M.Hoffmann-Ostenhof, and T.Hoffmann-Ostenhof. On the Asymptotics of Nodes of L2-Solutions of Schrödinger Equations in Dimensions >=3. Commun.Math.Phys. 117: 49-77, 1988 |
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88-013 A.Beyer, P.Wolschann, A.Becker, E.Pranka, and G.Buchbauer. Conformational Calculations on Odoriferous Molecules of Sandalwood. I. The Search for the Odoriferous Principle of Sandalwood Oil. MH.Chem. 119: 711-715, 1988 |
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88-014 A.Beyer, P.Wolschann, A.Becker, G.Buchbauer, and S.Winiwarter. Conformational Calculations on Sandalwood Odour Molecules II. Force Field Investigations on \beta-Santalol. Flavour and Fragrance J. 3: 173-117, 1988 |
1987
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87-001 P.Schuster. Hydrogen Bonds. In: R.A.Meyers, ed. The Encyclopedia of Physical Science and Technology, Academic Press, pp.518-554, 1987 |
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87-002 P.Schuster. Structure and Dynamics of Replication-Mutation Systems. Physica Scripta 35: 402-416, 1987 |
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87-003 P.Schuster. Molekulare Evolution und Ursprung des Lebens. In: B.O.Küppers, ed. Ordnung aus dem Chaos. Piper, pp.49-84, 1987 |
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87-004 W.Fontana, and P.Schuster. A Computer Model of Evolutionary Optimization. Biophys.Chem. 26: 123-147, 1987 |
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87-005 P.Schuster, and K.Sigmund. Evolutionary Game Dynamics. In: I.Prigogine, M.Sanglier, ed. Laws of Nature and Human Conduct, G.O.R.D.E.S. Task Force of Research. Information and Study on Science, pp.229-236, Brussels 1987 |
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87-006 O.E.Polansky, P.Schuster, C.I.Ivanov, and N.Tyutyulkov. Structure and Properties of Nonclassical Polymers. V. On a Class of Nonalternant Polymers with Localized Nonbonding Bands. Int.J.Quant.Chem. 32: 491-499, 1987 |
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87-007 P.Schuster. Theoretical Models of Molecular Evolution. In: G.Marx, ed. Proceedings of the Symposium: Chaos in Education, pp.109-142, Lake Balaton 1987 |
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87-008 P.Schuster, and K.Sigmund. Self-Organization of Macromolecules. In: F.E.Yates, ed. Self-Organizing Systems: The Emergence of Order. Plenum Press, pp.75-111, New York 1987 |
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87-009 Y.Bouteiller, C.Mijoule, A.Karpfen, H.Lischka, and P.Schuster. Theoretical Vibrational Investigation of Hydrogen Bonded Complexes: Application to CIH..NH3, CIH..NH2CH3, and BrH..NH3. J.Phys.Chem. 91: 4464-4466, 1987 |
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87-010 P.G.Szalay, A.Karpfen, and H.Lischka. SCF and Electron Correlation studies on structures and harmonic in-plane force fields of ethylene, trans 1,3-butadiene, and all-trans 1,3,5-hexatriene. J.Chem.Phys. 87: 3530-3538, 1987 |
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87-011 M.Kofranek, H.Lischka, and A.Karpfen. Ab initio Studies on Structure, Vibrational Spectra and Infrared Intensities of HCN, (HCN)2 and (HCN)3. Mol.Phys. 61: 1519-1539, 1987 |
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87-012 M.Kofranek, A.Karpfen, and H.Lischka. Ab Initio Studies on Hydrogen-Bonded Clusters. I. Linear and Cyclic Oligomers of Hydrogen Cyanide. Chem.Phys. 113: 53-64, 1987 |
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87-013 A.Karpfen. Ab Initio Studies on Polymers: Torsional Potential in Helical Sulfur Chains. Chem.Phys.Lett. 136: 571-574, 1987 |
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87-014 J.N.L.Connor, J.C.Whitehead, and W.Jakubetz. Orientation Dependence of the F+H2 Reaction. J.Chem.Soc.Faraday Trans.2 83: 1703-1718, 1987 |
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87-015 W.Jakubetz. Die Untersuchung chemischer Reaktionen im molekularen Bereich. Österr.Chem.Z. 1: 2-8, 1987 |
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87-016 B.Amaee, J.N.L.Connor, J.C.Whitehead, W.Jakubetz, and G.C.Schatz. Dynamics of Heavy+Light-Heavy Atom Transfer Reactions. The Reaction Cl+HCl -> ClH+Cl. Faraday Discuss.Chem.Soc. 84: 387-403, 1988 |
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87-017 O.Steinhauser, I.Hausleithner, and H.Bertagnolli. The Binary System Benzene-Hexafluorbenzene Studied by SSOZ Theory and Computer Simulation. I. The Charge Symmetry Model. Chem.Phys. 111: 371-387, 1987 |
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87-018 M.Hoffmann-Ostenhof, T.Hoffmann-Ostenhof, and J.Swetina. Asymptotics and Continuity Properties Near Infinity of Solutions of Schrödinger Equations in Exterior Domains. Ann.Inst.Henri Poincare 46: 247-280, 1987 |
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87-019 G.Köhler, and P.Wolschann. Steady-State and Time-resolved Fluorescence Study of Excited-state Proton Transfer in 1-Aminoalkyl-2-naphthols. J.Chem.Soc.Faraday Trans 2 83: 513-527, 1987 |
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87-020 A.Beyer, P.Wolschann, A.Becker, G.Buchbauer, and K.Mraz. Empirical Force Field Calculations on Sandalwood Odor Molecules. Eur.J.Med.Chem. 22: 479-480, 1987 |
1986
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86-001 P.Schuster. The Interface Between Chemistry and Biology - Laws Determining Regularities in Early Evolution. In: G.Pifat-Mrzljak, ed. Supramolecular Structure and Function. Springer, pp.154-185, Berlin 1986 |
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86-002 P.Schuster. Mechanisms of Molecular Evolution. In: S.W.Fox, ed. Selforganization. Adenine Press pp.57-91, 1986 |
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86-003 P.Schuster. Polynucleotides - A Class of Self-Organizing Biomolecules. In: C.W.Kilminster, ed. Disequilibrium and Self-Organization D.Reidel, pp.165-168, 1986 |
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86-004 P.Schuster. The Physical Basis of Molecular Evolution. Chemica Scripta 26B: 27-41, 1986 |
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86-005 P.Schuster. Dynamics of Molecular Evolution. Physica D 22: 100-119, 1986 |
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86-006 H.Lischka, and A.Karpfen. Ab Initio Calculations on the Excited States of pi-Systems. I. Valence Excitations in Acetylene. Chem.Phys. 102: 77-89, 1986 |
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86-007 A.Karpfen, and H.Lischka. Ab Initio Calculations on the Excited States of pi-Systems. II. Valence Excitations in Diacetylene. Chem.Phys. 102: 91-102, 1986 |
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86-008 W.Jakubetz, T.Joseph, and J.Manz. Selective IR-Multiphoton Excitation of Hyperspherical Modes. Chem.Phys.Lett. 126: 48-53, 1986 |
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86-009 M.Hoffmann-Ostenhof, T.Hoffmann-Ostenhof, and J.Swetina. Continuity and Nodal Properties Near Infinity for Solutions of 2-Dimensional Schrˆdinger Equations. Duke Math.J. 53: 271-306, 1986 |
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86-010 H.Kalchhauser, and P.Wolschann. Investigation of Dynamic Equilibria Using NMR-Spectroscopy III. Saturation Transfer Experiments on the Hydration of Pyridine-4-Carbaldehyd. Mh.Chem. 117: 841-848, 1986 |
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86-011 F.Ganster, J.Hˆttinger, N.M¸ller, P.Federspiel, M.Potschka, M.Schlederer, and P.Wolschann. The Use of APPLE II Microcomputer as Kinetic Laboratory Data Acquisition System. Mh.Chem. 117: 1145-1156, 1986 |
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86-012 M.Potschka. Structure of Intermediate Filaments. Biophys.J. 49: 129-130, 1986 |
1985
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85-001 P.Schuster, and K.Sigmund. Towards a Dynamics of Social Behaviour. Strategies and Genetic Models for the Evolution of Animal Conflicts. J.Soc.Biol.Struct. 8: 255-277, 1985 |
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85-002 N.Tyutyulkov, O.E.Polansky, P.Schuster, S.Karabunarliev, and Ch.I.Ivanov. Structure and Properties of Non-Classical Polymers II. Band Structure and Spin densities. Theor.Chim.Acta 67: 211-228, 1985 |
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85-003 P.Schuster, and K.Sigmund. Dynamics of Evolutionary Optimization. Ber.Bunsenges.Phys.Chem. 89: 668-682, 1985 |
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85-004 L.Demetrius, P.Schuster, and K.Sigmund. Polynucleotide Evolution and Branching Processes. Bull.Math.Biol. 47: 239-262, 1985 |
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85-005 A.Karpfen, and P.Schuster. Ab Initio Studies on Hydrogen Bonded Chains. V. The Structure of Infinite Chains of Methanol and Water Molecules. Can.J.Chem. 63: 809-815, 1985 |
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85-006 P.E.Phillipson, P.Schuster, and R.G.Johnston. An Analytical Study of the May-Leonard Equations. SIAM J.Appl.Math. 45: 541-554, 1985 |
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85-007 P.Schuster. Effects of Finite Population Size and Other Stochastic Phenomena in Molecular Evolution. In: H.Haken, ed. Complex Systems - Operational Approaches. Springer, pp.16-35, Berlin 1985 |
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85-008 A.Karpfen, and P.Schuster. Ion-Molecule Interactions - A Quantum Chemical Approach to Primary Solvation. In: R.R.Dogonadze, E.Kalman, A.A.Kornyshev, J.Ulstrup, eds. The Chemical Physics of Solvation, Part A: Theory of Solvation Elsevier, pp.265-312, Amsterdam 1985 |
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85-008a P.Schuster. The Interface Between Chemistry and Biology - Laws Determining Regularities in Early Evolution. In: J.-P.Aubin, D.Saari, K.Sigmund, eds. Lecture Notes in Economics and Mathematical Systems. Dynamics of Macrosystems, Bd.257, Springer pp.239-252, 1985 |
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85-009 R.Ahlrichs, H.-J.Bˆhm, C.Erhard, P.Scharf, H.Schiffer, H.Lischka, and M.Schindler. Implementation of an Electronic Structure Program System on the CYBER 205. J.Comput.Chem. 6: 200--208, 1985 |
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85-010 W.Jakubetz. A Two-Mechanism Model of the H+F2 Reaction. Chem.Phys. 92: 307-317, 1985 |
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85-011 A.Karpfen. Ab initio studies on polyynes and polydiacetylenes: Structure and harmonic force field. In: D.Bloor and R.R.Chance, eds. Polydiacetylenes, Synthesis, Structure and Electronic Properties NATO-ASI Series E102, Martinus Nijhoff Publ., pp 115-124, Dordrecht 1985 |
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85-012 H.Bertagnolli, I.Hausleithner, and O.Steinhauser. Symmetry reduction of the RISM equation. Chem.Phys.Letters 116: 465-470, 1985 |
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85-013 T.Hoffmann-Ostenhof, M.Hoffmann-Ostenhof, and J.Swetina. Pointwise bounds on the asymptotics of spherically averaged L2-solutions of one-body Schrˆdinger operators. Ann. Inst. H. PoincarÈ, Sec. A 42: 341-361, 1985 |
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85-014 G.Winkler, P.Wolschann, P.Briza, F.Heinz, and C.Kunz. Spectral Properties of Trifluoroacetic Acid - Acetonitril Gradient Systems for Separation of Picomole Quantities of Peptides by Reversed-Phase High Performance Liquid Chromatography. J. of Chromatography 347: 83, 1985 |
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85-015 A.K.Konopka, J.Reiter, M.Jung, D.A.Zarling, and T.M.Jovin. Concordance of Experimentally Mapped or Predicted Z-DNA Sites with Positions of Selected Alternating Purine-Pyrimidine Tracts. Nucleic Acids Res. 13: 1683-1700, 1985 |
1984
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84-001 A.Beyer, A.Karpfen, and P.Schuster. Energy Surfaces of Hydrogen Complexes in the Vapour Phase. Topics in Current Chemistry 120: 1-40, 1984 |
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84-002 P.Schuster, and K.Sigmund. Random Selection - a Simple Model Based on Linear Birth and Death Processes. Bull.Math.Biol. 46: 11-17, 1984 |
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84-003 P.Schuster, and K.Sigmund. Random Selection and the Neutral Theory - Sources of Stochasticity in Replication. In: P.Schuster, ed. Stochastic Phenomena and Chaotic Behaviour in Complex Systems. Springer Series in Synergetics Vol.21, Springer, pp.186-205, Berlin 1984 |
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84-004 P.E.Phillipson, P.Schuster, and F.Kemler. Dynamical Machinery of a Biochemical Clock. Bull.Math.Biol. 46: 339-355, 1984 |
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84-005 P.Schuster. Coevolution of Proteins and Nucleic Acids. In: H.E.A.Schenk, W.Schwemmler, eds. Endocytobiology Vol.II Gruyter, pp.3-28, Berlin 1984 |
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84-006 P.Schuster. Evolution Between Chemistry and Biology. Origins of Life 14: 3-14, 1984 |
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84-007 J.Hofbauer, and P.Schuster. Dynamics of Linear and Nonlinear Autocatalysis and Competition. In: P.Schuster, ed. Stochastic Phenomena and Chaotic Behaviour in Complex Systems. Springer Series in Synergetics, Vol.21. Springer, pp.169-172, Berlin 1984 |
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84-008 K.Sigmund, and P.Schuster. Permanence and Uninvadability for Deterministic Population Models. In: P.Schuster, ed. Stochastic Phenomena and Chaotic Behaviour in Complex Systems. Springer Series in Synergetics, Vol.21. Springer, pp.173-184, Berlin 1984 |
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84-009 A.M.Rodriguez-Vargas, and P.Schuster. The Dynamics of Catalytic Hypercycles - A Stochastic Simulation. In: P.Schuster, ed. Stochastic Phenomena and Chaotic Behaviour in Complex Systems. Springer Series in Synergetics, Vol.21. Springer, pp.208-219, Berlin 1984 |
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84-010 P.Schuster. Polynucleotide Replication and Biological Evolution. In: E.Frehland, ed. Synergetics - From Microscopic to Macroscopic Order. Springer Series in Synergetics, Vol.22. Springer-Verlag, pp.106-121, Berlin 1984 |
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84-011 P.Schuster. Commentary: On the Origin of Optical Activity. Adv.Chem.Phys. 55: 109, 1984 |
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84-012 A.Brzic, A.Karpfen, H.Lischka, and P.Schuster. A Candidate for an Ion Pair in the Vapour Phase: Proton Transfer in the Complex R3N.HX . Chem.Phys. 89: 337-343, 1984 |
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84-013 P.Schuster. Physical Basis of Evolution. In: Z.Roter, F.Rode, eds. Science and Faith Slovene Academy of Science and Arts, pp.159-166, Ljubljana 1984 |
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84-014 P.Schuster. Kinetics of Complex Selfreplicating Molecular Systems. In: J.Ricard, A.Cornish-Bowden, eds. Dynamics of Biochemical Systems. Plenum Publ.Co., pp.273-295, New York 1984 |
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84-015 P.Schuster. Polynucleotide Evolution, Hypercycles and the Origin of the Genetic Code. Adv.Space Res. 4: 143-151, 1984 |
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84-016 P.Schuster, ed. Stochastic Phenomena and Chaotic Behaviour in Complex Systes. Springer Series in Synergetics, Vol.XXI. Springer-Verlag, Berlin 1984 |
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84-017 P.Russegger, and H.Lischka. Theoretical Study of the Photochemistry of Carbonyl Compounds: Potential Energy Surface for the Photodissociation of Propynal. Chem.Phys. 86: 31-39, 1984 |
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84-018 H.-J.Köhler, D.Volkmann, and H.Lischka. Quantenchemische Untersuchungen an einfachen siliciumanalogen Kohlenwasserstoffen: Disilen . Z.Chem. 24; 155-156, 1984 |
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84-019 H.-J.Köhler, and H.Lischka. Bridged Structures in Multiply Bonded Silicon Compounds: Disilyne, Protonated Dysilyne and Disilene. Chem.Phys.Lett. 112: 33-40, 1984 |
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84-020 W.Jakubetz. Some Theoretical and Experimental Aspects of the Dynamics of the H(D)+Cl2 Reaction Re-examined. Chem.Phys. 88; 271-288, 1984 |
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84-021 A.Karpfen, and A.Beyer. Ab initio studies on polymers. VI. Torsional potential in regular polyethylene chains. J.Comp.Chem. 5: 11-18, 1984 |
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84-022 A.Karpfen, and A.Beyer. Ab initio studies on polymers. VII. Polyoxymethylene. J.Comp.Chem. 5: 19-23, 1984 |
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84-023 A.Karpfen. Ab initio studies on the structure and phonon spectra of simple polymers. In: J.Ladik und J.M.Andre, eds. Quantum Chemistry of Polymers - Solid State Aspects NATO-ASI Series C123, Reidel, pp.33-55, Dordrecht 1984 |
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84-024 A.Karpfen. Ab initio studies on hydrogen bonded chains. IV. Structure and stability of formic acid chains. Chem.Phys. 88: 415-423, 1984 |
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84-025 A.Karpfen. Ab initio Berechnung von Potentialflächen in Polymeren. In: H.Sixl, ed. Photoreaktive Festkörper, VW-Symp., Mittelberg, M.Wahl-Verlag, pp. 397-414, Karlsruhe, 1984 |
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84-026 A.Karpfen. Ab initio studies on polymers. VI. Torsional potential in regular polyethylene chains. J.Comp.Chem. 5: 11-18, 1984 |
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84-027 A.Karpfen, and A.Beyer. Ab initio studies on polymers. VII. Polyoxymethylene. J.Comp.Chem. 5: 19-23, 1984 |
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84-028 A.Karpfen. Ab initio studies on the structure and phonon spectra of simple polymers. In: J.Ladik und J.M.Andre, eds. Quantum Chemistry of Polymers - Solid State Aspects NATO-ASI Series C123, Reidel, pp.33-55, Dordrecht 1984 |
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84-029 A.Karpfen. Ab initio studies on hydrogen bonded chains. IV. Structure and stability of formic acid chains. Chem.Phys. 88: 415-423, 1984 |
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84-030 M.Neumann, and O.Steinhauser. Consistent calculation of the static and frequency- dependent dielectric constant in computer simulations. Mol.Phys. 52: 97-113, 1984 |
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84-031 M.Neumann, and O.Steinhauser. Computer simulation and the dielectric constant of polar polarizable systems. Chem.Phys.Lett. 106: 563-573, 1984 |
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84-032 T.Hoffmann-Ostenhof, and M.Hoffmann-Ostenhof. On embedded eigenvalues for the one-dimensional Schrödinger equation. J.Math.Phys. 25(8): 2490-2493, 1984 |
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84-033 T.Hoffmann-Ostenhof, and M.Hoffmann-Ostenhof. Absence of an L2-eigenfunction at the bottom of the spectrum of the Hamiltonian of the Hydrogen negative ion in the triplet S-sector. J.Phys. A17: 3321-3325, 1984 |
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84-034 H.Falk, P.Wolschann, and U.Zrunek. Beiträge zur Chemie der Pyrrolpigmente 53.Mitt.. Phytochrommodellstudien. Das Säure-Basen-Gleichgewicht diastereomerer 2,3-Dihydrobilatriene-abc. Mh.Chem. 115: 243-249, 1984 |
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84-035 E.Haslinger, H.Kalchhauser, and P.Wolschann. Cis-Trans-Isomerisation of the Proline-Peptide-Bond in a Cyclic Tetrapeptide Related to Chlamydocin. Mh.Chem. 115: 779-783, 1984 |
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84-036 E.Haslinger, M.Reithmaier, W.Robien, and P.Wolschann. 15N - NMR - Studies on the Neutralization Reaction of Arylidene Dimethyl Barbituric Acids. Organic Lewis Acids 38. Mh.Chem. 115: 375-381, 1984 |
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84-037 E.Haslinger, M.Schlederer, W.Robien, and P.Wolschann. Hydrogen Bonding and Tautomeric Equilibria of Complexes of Pyridine with various Proton Donors. A Nitrogen-15 Nuclear Magnetic Resonance Study. Mh.Chem. 115: 1345-1351, 1984 |
1983
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83-001 P.Schuster. Evolution of Polynucleotides - An Analytical Access to Darwins Theory from the View of Molecular Biology. Kühlungsborner Kolloquium Darwin Today. Akademie Verlag, 151-169, Berlin 1983 |
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83-002 P.Schuster. Selection and Evolution in Molecular Systems - a Combined Approach to Stochastic and Deterministic Chemical Kinetics. In: B.Gomez, S.M.Moore, A.M.Rodriguez-Vargas, A.Rueda, eds. Stochastic Processes Applied to Physics and other Related Fields, ACIF-Series Vol.1, World Scientific Publ.Co. pp.134-159, 1983 |
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83-003 P.Schuster. Evolution of Polynucleotides. In: G.Pifat, J.N.Herak, eds. Supramolecular Structure and Function, Plenum Press, pp.309-356, New York 1983 |
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83-004 P.Schuster. Evolution of Molecules. In: P.O.Löwdin, B.Pullman, eds. New Horizons of Quantum Chemistry. D.Reidel, pp.417-437, Dordrecht 1983 |
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83-005 N.Tyutyulkov, P.Schuster, and O.E.Polansky. Band Structure of Nonclassical Polymers. Theor.Chim.Acta 63: 291-304, 1983 |
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83-006 I.M.Bomze, P.Schuster, and K.Sigmund. The Role of Mendelian Genetics in Strategic Models on Animal Behaviour. J.Theor.Biol. 101: 19-38, 1983 |
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83-007 P.Schuster, and K.Sigmund. Replicator Dynamics. J.Theor.Biol. 100: 533-538, 1983 |
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83-008 P.E.Phillipson, and P.Schuster. Analytical Solution of Coupled Nonlinear Rate Equations II. Kinetics of Positive Feedback Loops. J.Chem.Phys. 79: 3807-3818, 1983 |
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83-009 P.Schuster. Zufall und Chaos - die Rolle von Fluktuationen bei chemischen Reaktionen. Österr.Chemie Zeitschrift 84: 61-70, 1983 |
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83-010 P.Schuster. Evolution - Von Molekülen zu Gesellschaften. Teil I: Dynamik der Polynukleotidreplikation. Physik i.u.Zeit 14: 66-80, 1983 |
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83-011 A.Karpfen, A.Beyer, and P.Schuster. Ab initio Studies on Clusters of Polar Molecules. Stability of Cyclic versus open chain trimers of hydrogen fluoride. Chem.Phys.Lett. 102: 289-291, 1983 |
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83-012 P.Schuster. Zur Entstehung des Lebens. In: Peter Lang, ed. Selbstorganisation der Materie Universität Bern, pp.97-113, Bern 1983 |
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83-013 P.Schuster. Entwicklung der belebten Natur. GRS Auswertung von Betriebserfahrungen in Kernkraftwerken 7.GRS Fachgespräch, pp.5-11, München 1983 |
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83-014 Th.Weller, W.Meiler, H.Pfeifer, H.Lischka, and R.Höller. Equilibrium Geometry and the 13C, 17O, 23Na and 7Li NMR Shielding Tensors of the Systems Na+/CO and Li+/CO. Chem.Phys.Lett. 95: 599-603, 1983 |
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83-015 H.-J.Köhler, and H.Lischka. The Structure of Protonated Disilene. Chem.Phys.Lett. 98: 454-456, 1983 |
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83-016 Th.Weller, H.-J.Köhler, H.Lischka, and R.Höller. Ab Initio Calculations of Magnetic Properties of CO, the Equilibrium Geometry and the 13C, 17O, 23Al NMR Shielding Tensors of the System Al+/CO. Chem.Phys.Lett. 98: 541-544, 1983 |
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83-017 H.Lischka, and H.-J.Köhler. Ab Initio Investigation on the Lowest Singlet and Triplet State of Si2H2. J.Am.Chem.Soc. 105: 6646-6649, 1983 |
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83-018 W.Jakubetz. The Orientation-Averaged Rotation-Decoupled Vibration Model for Product State Distributions in Light+Heavy+Heavy Reactions. Chem.Phys. 75: 45-57, 1983 |
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83-019 W.Jakubetz. Vibrational Product Distributions from Moments Methods: A Systematic Invetigation for a Simplistic Model System. Chem.Phys. 81: 397-417, 1983 |
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83-020 P.R.Surjan, M.Kertesz, A.Karpfen, and J.Koller. Ab initio numerical studies on density-matrix asymptotics in extended systems. Phys.Rev. B27: 7583-7588, 1983 |
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83-021 A.Karpfen. Ab initio studies on hydrogen bonded chains. III. The linear, infinite chain of hydrogen cyanide molecules. Chem.Phys. 79: 211-218, 1983 |
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83-022 M.Neumann, and O.Steinhauser. On the calculation of the dielectric constant using the Ewald-Kornfeld tensor. Chem.Phys.Letters 95: 417-422, 1983 |
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83-023 O.Steinhauser. On the dielectric theory and computer simulation of water. Chem.Phys. 79: 465-478, 1983 |
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83-024 O.Steinhauser. On the orientational structure and dielectric properties of water. Ber.Bunsenges.Phys.Chem. 87: 128-142, 1983 |
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83-025 M.Neumann, and O.Steinhauser. On the calculation of the frequency-dependent dielectric constant in computer simulations. Chem.Phys.Letters 102: 508-513, 1983 |
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83-026 T.Hoffmann-Ostenhof, M.Hoffmann-Ostenhof, and B.Simon. A multiparticle Coulomb system with bound state at threshold. J.Phys. A16: 1125-1131, 1983 |
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83-027 T.Hoffmann-Ostenhof, R.Froese, I.Herbst, and M.Hoffmann-Ostenhof. L2-lower bounds to solutions of one-body Schrödinger equations. Proc.Royal Soc.Edinburgh 95A: 25-38, 1983 |
1982
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82-001 P.Schuster, and K.Sigmund. A Note on the Evolution of Sexual Dimorphism. J.Theor.Biol. 94: 107-110, 1982 |
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82-002 P.Schuster, and K.Sigmund. From Biological Macromolecules to Protocells - The Principle of Early Evolution. In: W.Hoppe, W.Lohmann, H.Markl und H.Ziegler, eds. Biophysics, 2.Auflage. Springer, pp.874-912, Berlin 1982 |
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82-002a P.Schuster, and K.Sigmund. Vom Makromolekül zur primitiven Zelle - Das Prinzip der frühen Evolution. In: W.Hoppe, W.Lohmann, H.Markl und H.Ziegler, eds. Biophysik - Ein Lehrbuch, 2.Auflage. Springer, pp.907-947, Berlin 1982 |
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82-003 P.Schuster. Irreversible Thermodynamics - An Overview. In: W.Hoppe, W.Lohmann, H.Markl, H.Ziegler, eds. Biophysics, 2. Auflage. Springer, pp.330-347, Berlin 1982 |
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82-003a P.Schuster. Irreversible Thermodynamik - Ein Überblick. In: W.Hoppe, W.Lohmann, H.Markl, H.Ziegler, eds. Biophysik - Ein Lehrbuch, 2. Auflage. Springer, pp.341-359, Berlin 1982 |
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82-004 J.Hofbauer, P.Schuster, and K.Sigmund. Game Dynamics in Mendelian Populations. Biol.Cybern 43: 51-57, 1982 |
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82-005 B.Gassner, and P.Schuster. Model Studies on RNA-Replication I. The Quasiequilibrium Assumption and the Analysis of a Simplified Mechanism. Mh.Chem. 113: 237-263, 1982 |
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82-006 M.Eigen, and P.Schuster. Stages of Emerging Life - Five Principles of Early Organization. J.Mol.Evol. 19: 47-61, 1982 |
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82-007 J.Swetina, and P.Schuster. Self-Replication with Errors - A Model for Polynucleotide Replication. Biophys.Chem. 16: 329-345, 1982 |
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82-008 H.Lischka, and H.-J.Köhler. On the Structure and Stability of Singlet and Triplet Disilene and Silylsilylene. Chem.Phys.Lett. 85: 467-471, 1982 |
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82-009 Th.Weller, W.Meiler, A.Michael, H.-J.Köhler, H.Lischka, and R.Höller. Ab Initio Calculation of the Equilibrium Geometry and the 13C, 17O and 27Al NMR Chemical Shielding Tensors of the System Al3+/CO. Chem.Phys. 72: 155-15, 1982 |
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82-010 H.-J.Köhler, and H.Lischka. A Systematic Investigation on the Structure and Stability of the Lowest Singlet and Triplet States of Si2H4 and SiH3SiH and the analogous carbon compounds SiH2CH2, SiH3CH, CH3SiH, C2H4 and CH3CH. J.Am.Chem.Soc. 104: 5884-5889, 1982 |
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82-011 J.N.L.Connor, W.Jakubetz, A.Laganá, J.Manz, and J.C.Whitehead. The Reaction X+Cl2 -> XCl+Cl (X=Mu,H,D). II. Comparison of Experimental Data With Theoretical Results Derived from a New Potential Energy Surface. Chem.Phys. 65: 29-48, 1982 |
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82-012 A.Beyer, and A. Karpfen. Ab initio studies on hydrogen bonded chains. II. Equilibrium geometry and vibrational spectra of the bent chain of hydrogen fluoride molecules. Chem.Phys. 64: 343-357, 1982 |
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82-013 A.Karpfen. Ab initio calculations on the ground state properties of polymers. Phys.Scripta T1 79-87, 1982 |
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82-014 O.Steinhauser. On the structure and dynamics of liquid benzene. Chem.Phys. 73: 155-167, 1982 |
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82-015 O.Steinhauser. Reaction field simulation of water. Mol.Phys. 45: 335-348, 1982 |
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82-016 O.Steinhauser. The continuum analogue of multipolar lattice sums. Ber.Bunsenges.Phys.Chem. 86: 335-338, 1982 |
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82-017 O.Steinhauser. Computer simulation of polar liquids. The influence of the molecular shape. Mol.Phys. 46: 827-837, 1982 |
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82-018 T.Hoffmann-Ostenhof, R.Froese, I.Herbst, and M.Hoffmann-Ostenhof. L2-exponential lower bounds to solutions of the Schrödinger equations. Commun.Math.Phys. 87: 265-286, 1982 |
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82-019 T.Hoffmann-Ostenhof, R.Froese, I.Herbst, and M.Hoffmann-Ostenhof. On the absence of positive eigenvalues for one-body Schrödinger operators. J.d'Anal. 41: 272-284, 1982 |
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82-020 E.Haslinger, H.Kalchhauser, and P.Wolschann. Intermolecular Interactions II. Weak Intramolecular Interactions in Derivatives of Barbituric Acid. Mh.Chem. 113: 633-640, 1982 |
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82-021 W.Robien, H.Völlenkle, and P.Wolschann. Intramolecular Interactions III. On the Geometry of Alkylaminomethylphenols. Zeitschr.f.Phys.Chem. 130: 123-128, 1982 |
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82-022 E.Liedl, and P.Wolschann. The Reaction of Activated Nitrones to Carbon - Carbon Double Bonds of Organic Lewis Acids. Organic Lewis Acids 37. Mh.Chem. 113: 1067-1071, 1982 |
1981
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81-001 P.Schuster. Selforganization and Integration of Information Stored in Selfreplicative Units. In: G.Roth, H.Schwegler, eds. Selforganizing Systems. Campus, pp.47-61, Frankfurt 1981 |
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81-002 P.Schuster, and K.Sigmund. Coyness, Philandering and Stable Strategies. Animal Behaviour. 29: 186-192, 1981 |
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81-003 J.Hofbauer, P.Schuster, and K.Sigmund. Competition and Cooperation in Catalytic Selfreplication. J.Math.Biol. 11: 155-168, 1981 |
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81-004 P.Schuster. Prebiotic Evolution. In: H.Gutfreund, ed. Biochemical Evolution. Cambridge Univ.Press, Cambridge (U.K.) pp.15-87, 1981 |
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81-005 P.Schuster, K.Sigmund, J.Hofbauer, and R.Wolff. Selfregulation of Behaviour in Animal Societies. I. Symmetric Contests. Biol.Cybern. 40: 1-8, 1981 |
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81-006 P.Schuster, K.Sigmund, J.Hofbauer, and R.Wolff. Selfregulation of Behaviour in Animal Societies.II. Games between two Populations without Selfinteraction. Biol.Cybern. 40: 9-15, 1981 |
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81-007 P.Schuster, K.Sigmund, J.Hofbauer, R.Wolff, R.Gottlieb, and P.Merz. Selfregulation of Behaviour in Animal Societies.III. Games between two Populations with Selfinteraction. Biol.Cybern. 40: 17-25, 1981 |
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81-008 M.Eigen, W.Gardiner, P.Schuster, and R.Winkler-Oswatisch. The Origin of the Genetic Information. Sci.Am. 244(4) 88-118, 1981 |
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81-008a M.Eigen, W.Gardiner, P.Schuster, and R.Winkler-Oswatisch. Ursprung der genetischen Information. Spektrum 6: 36-56, 1981 |
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81-009 A.Karpfen, A.Beyer, and P.Schuster. Hydrogen Bonding in Clusters and Molecular Crystals. Int.J.Quant.Chem. 19:1113-1119, 1981 |
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81-010 P.Schuster. Selection and Evolution in Molecular Systems. In: R.H.Enns, B.J.Jones, R.Miura, S.Rangnekar,eds. Nonlinear Phenomena in Physics and Biology. Plenum Press, pp.485-548, New York 1981 |
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81-011 P.Schuster. Zwischenmolekulare Kräfte - Ein Beispiel für das Zusammenwirken von Theorie und Experiment. Angew.Chem. 93: 532-553, 1981 |
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81-011a P.Schuster. Intermolecular Forces. An Example of Fruitful Cooperation of Theory and Experiment. Angew.Chem.Int.Ed. 20: 546-568, 1981 |
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81-012 S.Basu, P.Schuster, and P.Wolschann. Nukleophile Additionen an Doppelbindungssysteme II. Die Kinetik der Reaktion aromatischer Aldehyde mit Sulfit. MH.Chem. 112: 421-428, 1981 |
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81-013 M.Eigen, and P.Schuster. Comments on: Growth of a Hypercycle by King. BioSystems 13: 235, 1981 |
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81-014 P.Schuster, and K.Sigmund. Mathematical Models on Selfregulation of Behaviour in Animal Societies. Progress Report of the 8th Int.Conference of the Institut de la Vie: From Theoretical Physics to Biology. Versailles, 1981 |
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81-015 R.Höller, and H.Lischka. A Coupled Hartree-Fock Study on Nuclear Magnetic Shielding in (HF)2 and (H2O)2. Chem.Phys.Lett. 84: 94-98, 1981 |
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81-016 H.Lischka, R.Shepard, F.Brown, and I.Shavitt. New Implementation of the Graphical Unitary Group approach for Multireference Direct Configuration Interaction Calculations. Int.J.Quantum Chem. S15: 91-100, 1981 |
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81-017 J.N.L.Connor, J.C.Whitehead, W.Jakubetz, and A.Laganá. On Differences Between Quasiclassical and Quantum Mechanical Vibrational Product Distributions in the Collinear H+Cl2 (v=2) and D+Cl2 (v=2) reactions. Nuovo Cimento 63B: 116-124, 1981 |
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81-018 A.Karpfen. Convergence problem in ab initio crystal orbital calculations. Intern.J.Quantum Chem. 19: 1207-1214, 1981 |
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81-019 A.Karpfen, and R.Höller. Cis-trans isomerism in infinite polyacetylenes: An ab initio study. Solid State Comm. 37: 179-182, 1981 |
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81-020 A.Karpfen. Ab initio studies on polymers V. All-trans polyethylene. J.Chem.Phys. 75: 238-245, 1981 |
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81-021 O.Steinhauser. Single particle dynamics of liquid carbon disulfide. Chem.Phys.Lett. 82: 153-157, 1981 |
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81-022 O.Steinhauser and H.Bertagnolli. Pair correlation functions of liquid CS2. Chem.Phys.Lett. 80: 89-93, 1981 |
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81-023 O.Steinhauser, and H.Bertagnolli. Molecular pair correlation function of liquid acetonitrile. Chem.Phys.Lett. 78: 555-559, 1981 |
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81-024 O.Steinhauser, and H.Bertagnolli. Invariant expansion coefficients of the molecular pair correlation of ZX4-systems. Ber.Bunsenges.Phys.Chem. 85: 45-52, 1981 |
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81-025 O.Steinhauser, and H.Bertagnolli. Pair correlation functions of liquid CCl4. Z.Phys.Chem. 124: 33-43, 1981 |
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81-026 T.Hoffmann-Ostenhof, and J.D.Morgan III. The qualitative behavior of the ground state wave function of H2+. J.Chem.Phys. 75: 843-846, 1981 |
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81-027 T.Hoffmann-Ostenhof, J.M.Gombes, and M.Hoffmann-Ostenhof. Asymptotics of atomic ground states: The relation between the ground state of helium and the ground state of He+. J.Math.Phys. 22: 1299-1305, 1981 |
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81-028 T.Hoffmann-Ostenhof, R.Ahlrichs, M.Hoffmann-Ostenhof, and J.D.Morgan III. Bounds on the decay of electron densities with screening. Phys.Rev. A23: 2106-2117, 1981 |
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81-029 H.Falk, Th.Schlederer, and P.Wolschann. Beiträge zur Chemie der Pyrrolpigmente 38. Zur Assoziation von Gallenpigmenten. Mh.Chem. 112 199-207, 1981 |
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81-030 H.Martinek, and P.Wolschann. Tautomerism of Some Aminophenols in aqueous Solution. Bull.Soc.Chim.Belges 90: 37-43, 1981 |
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81-031 J.Hofbauer. On the Occurrence of Limit Cycles in the Volterra-Lotka equation. Nonlinear Analysis 5: 1003-1005, 1981 |
1980
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80-001 J.Hofbauer, P.Schuster, K.Sigmund, and R.Wolff. Dynamical Systems under Constant Organization II: Homogeneous Growth Funktions of Degree p=2. SIAM J.Appl.Math. 38: 282-304, 1980 |
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80-002 P.Schuster, K.Sigmund, and R.Wolff. Mass Action Kinetics of Selfreplication in Flow Reactors. J.Math.Anal.Appl. 78: 88-112, 1980 |
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80-003 P.Schuster, A.Karpfen, and A.Beyer. Cooperative Phenomena in Molecular Systems. In: W.J.Orville-Thomas, H.Ratajczak, eds. Molecular Interactions, J.Wiley+Sons, pp.117-149, London 1980 |
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80-004 M.Eigen, P.Schuster, K.Sigmund, and R.Wolff. Elementary Step Dynamics of Catalytic Hypercycles. BioSystems 13: 1-22, 1980 |
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80-005 B.Schreiber, H.Martinek, M.Hoffmann-Ostenhof, P.Wolschann, and P.Schuster. An Analytical Approach to the Study of Coupled Chemical Equilibria. Mh.Chem. 111: 235-248, 1980 |
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80-006 P.Schuster, and K.Sigmund. Self-Organization of Biological Macromolecules and Evolutionary Stable Strategies. In: H.Haken, ed. Dynamics of Synergetics. Springer Verlag pp.156-169, Berlin, 1980 |
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80-007 P.Schuster, and K.Sigmund. A Mathematical Model of the Hypercycle. In: H.Haken,ed. Dynamics of Synergetics Springer Verlag pp.170-178, Berlin 1980 |
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80-008 M.Eigen, W.C.Gardiner, and P.Schuster. Hypercycles and Compartments: Compartments Assist - but do not replace -Hypercyclic Organization of Early Genetic Information. J.Theor.Biol. 85: 407-411, 1980 |
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80-009 R.Höller, and H.Lischka. A Theoretical Investigation on the Model Wittig Reaction PH3CH2 + CH2O -> PH3O + C2H4. J.Am.Chem.Soc. 102: 4632-4635, 1980 |
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80-010 R.Höller, and H.Lischka. Coupled Hartree-Fock Calculations on Susceptibilities and Magnetic Shielding Constants I. The First Row Hydrides LiH, BeH2, BH3, CH4, NH3, H2O and HF, and the Hydrocarbons C2H2, C2H4 and C2H6. Mol.Phys. 41: 1017-1040, 1980 |
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80-011 R.Höller, and H.Lischka. Coupled Hartree-Fock Calculations on Susceptibilities and Magnetic Shielding Constants II. The Second Row Hydrides NaH, MgH2, AlH3, SiH4, PH3, H2S and HCl. Mol.Phys. 41: 1041-1050, 1980 |
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80-012 F.Mark, H.Lischka, and F.Rosicky. Variational Solution of the Dirac Equation within a Multicenter Basis Set of Gaussian Functions. Chem.Phys.Lett 71: 507-521, 1980 |
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80-013 J.N.L.Connor, W.Jakubetz, and J.Manz. Quantum Collinear Reaction Probabilities for Vibrationally Excited Reactants: F+H2 (v=<2) -> FH(v'=<5)+H. Mol.Phys. 39: 799-816, 1980 |
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80-014 J.N.L.Connor, W.Jakubetz, J.Manz, and J.C.Whitehead. The Reaction X+Cl2 -> XCl+Cl (X=Mu,H,D). I. A New Inversion Procedure for Obtaining Potential Energy Surfaces from Experimental Detailed and Total Rate Coefficient Data. J.Chem.Phys. 72: 6209-6226, 1980 |
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80-015 J.N.L.Connor, W.Jakubetz, D.C.Mackay, and C.V.Sukumar. Properties of Regge Pole Positions and Residues for Interatomic Potentials. J.Phys.B:Atom.Molec.Phys. 13: 1823-1837, 1980 |
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80-016 A.Karpfen. Ab initio calculations on polyyne, polyene and polymethinimine. In: Recent Advances in the Quantum Theory of Polymers J.M.Andr, J.L.Brdas, J.Delhalle, J.Ladik G.Leroy und C.Moser,eds. Lecture Notes in Physics Series, Nr. 113 Springer Verlag pp.137-146, 1980 |
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80-017 A.Karpfen. Ab initio studies on hydrogen bonded chains. I. Equilibrium geometry of the infinite, linear chain of hydrogen fluoride molecules. Chem.Phys. 47: 401-406, 1980 |
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80-018 A.Karpfen. Ab initio studies on polymers IV. Polydiacetylenes. J.Phys. C13 5673-5689, 1980 |
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80-019 M.Neumann, and O.Steinhauser. The influence of boundary conditions used in machine simulations on the structure of polar systems. Mol.Phys. 39: 437-454, 1980 |
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80-020 O.Steinhauser, and M.Neumann. Structure and dynamics of liquid carbon tetrachloride. Mol.Phys. 40: 115-128, 1980 |
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80-021 T.Hoffmann-Ostenhof. A lower bound to the decay of ground states of two-electron atoms. Phys.Lett. 77A 140-142, 1980 |
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80-022 T.Hoffmann-Ostenhof. A Comparison theorem for differential inequalities with applications in quantum mechanics. J.Phys. A13 417-424, 1980 |
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80-023 T.Hoffmann-Ostenhof, M.Hoffmann-Ostenhof, and B.Simon. On the nodal structure of atomic eigenfunctions. J.Phys. A13 1131-1133, 1980 |
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80-024 T.Hoffmann-Ostenhof, M.Hoffmann-Ostenhof, and B.Simon. Brownian motion and a consequence of Harnack's inequality: nodes of quantum wave functions. Proc.Am.Math.Soc. 80: 301-305, 1980 |
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80-025 T.Hoffmann-Ostenhof, M.Hoffmann-Ostenhof, R.Ahlrichs, and J.D.Morgan III. On the exponential fall off of wave functions and electron densities. Springer LN in Physics 116: 62-67, 1980 |
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80-026 E.Haslinger, and P.Wolschann. Intramolecular Interactions I. The Use of some Mannich Bases of Naphthols as Model Compounds for Intramolecular Hydrogen Bonding. Mh.Chem. 111: 563-574, 1980 |
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80-027 W.Robien, L.Hellemans, and P.Wolschann. Consistent Force Field Calculations on the Geometry of Triethylamine. Mh.Chem. 111: 779-782, 1980 |