Search Results - "LÜTHI, H.-P" :: K.UTB vyhledávací portál | TBU Library Retrieval Portal

Structures and vibrational frequencies of the carbon molecules C2-C18 calculated by density functional theory

Structures and vibrational frequencies of the carbon molecules C2-C18 calculated by density functional theory

by Hutter, Juerg, Luethi, Hans Peter, Diederich, Francois
Published in Journal of the American Chemical Society (01.01.1994)

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SCS Fall Meeting 2019, General Information

SCS Fall Meeting 2019, General Information

by R. Alberto, H. P. Lüthi
Published in Chimia (01.08.2019)

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Journal Article

SCS Fall Meeting 2019, General Information

SCS Fall Meeting 2019, General Information

by R. Alberto, H. P. Lüthi
Published in Chimia (01.08.2019)

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PD Dr. Hans Peter Lüthi

PD Dr. Hans Peter Lüthi

by H. P. Lüthi
Published in Chimia (01.03.2017)

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PD Dr. Hans Peter Lüthi

PD Dr. Hans Peter Lüthi

by H. P. Lüthi
Published in Chimia (01.03.2017)

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Exploring Machine Learning Tools for the Prediction of the Stability of New Togni-type Reagents

Exploring Machine Learning Tools for the Prediction of the Stability of New Togni-type Reagents

by Koichi, Shungo, Lüthi, Hans P
Published in Chimia (18.12.2019)

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The Importance of Charge Transfer between the Retinal Chromophore and the Protein Environment in Bacteriorhodopsin: A Theoretical Analysis on Reduced and Oxidized Chromophores

The Importance of Charge Transfer between the Retinal Chromophore and the Protein Environment in Bacteriorhodopsin: A Theoretical Analysis on Reduced and Oxidized Chromophores

by Sakar, K., Vacek, G., Luthi, H. P., Nagashima, U.
Published in Photochemistry and photobiology (01.10.1997)

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An ab initio investigation of the potential energy surface of the benzene—neon van der Waals complex

An ab initio investigation of the potential energy surface of the benzene—neon van der Waals complex

by Brupbacher, Th, Lüthi, H.P., Bauder, A.
Published in Chemical physics letters (31.07.1992)

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Can the lowest two electronic states of Si2 be ordered?

Can the lowest two electronic states of Si2 be ordered?

by LÜTHI, H. P, MCLEAN, A. D
Published in Chemical physics letters (10.04.1987)

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Correlating the Molecular Electrostatic Potentials of Some Organic Peroxides with Their Antimalarial Activities

Correlating the Molecular Electrostatic Potentials of Some Organic Peroxides with Their Antimalarial Activities

by Jefford, Charles W, Grigorov, Martin, Weber, Jacques, Lüthi, Hans P, Tronchet, Jean M. J
Published in Journal of Chemical Information and Computer Sciences (01.03.2000)

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Metacomputing, an emerging technology?: Parallel computing in chemical physics

Metacomputing, an emerging technology?: Parallel computing in chemical physics

by LÜTHI, H. P
Published in Computer physics communications (2000)

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Platinum(II) complexes with four ligating phosphorus atoms. Crystal and molecular structure of [Pt(PEt3)4]-(ClO4)2. Discussion of electronic spectra of planar and tetrahedrally distorted PtP4 chromophores

Platinum(II) complexes with four ligating phosphorus atoms. Crystal and molecular structure of [Pt(PEt3)4]-(ClO4)2. Discussion of electronic spectra of planar and tetrahedrally distorted PtP4 chromophores

by Kozelka, J., Lüthi, H.-P., Dubler, E., Kunz, R.W.
Published in Inorganica Chimica Acta (15.09.1984)

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Network supercomputing: A distributed-concurrent direct SCF scheme

Network supercomputing: A distributed-concurrent direct SCF scheme

by L thi, Hans P., Alml f, J.
Published in Theoretica Chimica Acta (01.01.1993)

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N,N-Dialkylaniline-Substituted Tetraethynylethenes: A New Class of Chromophores Possessing an Emitting Charge-Transfer State. Experimental and Computational Studies

N,N-Dialkylaniline-Substituted Tetraethynylethenes: A New Class of Chromophores Possessing an Emitting Charge-Transfer State. Experimental and Computational Studies

by Gobbi, Luca, Elmaci, Nuran, Lüthi, Hans Peter, Diederich, François
Published in Chemphyschem (16.07.2001)

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The low-frequency vibrations of triptycene

The low-frequency vibrations of triptycene

by Furlan, Alan, Fischer, Thomas, Fluekiger, Peter, Guedel, Hans Ulrich, Leutwyler, Samuel, Luethi, Hans Peter, Riley, Mark J, Weber, Jacques
Published in Journal of physical chemistry (1952) (01.12.1992)

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The Photohydration of N-Alkylpyridinium Salts: Theory and Experiment

The Photohydration of N-Alkylpyridinium Salts: Theory and Experiment

by King, Rollin A., Lüthi, Hans P., Schaefer, III, Henry F., Glarner, Fabrice, Burger, Ulrich
Published in Chemistry : a European journal (17.04.2001)

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Ab initio studies on the thermodynamic stability of the icosahedral C60 molecule Buckminsterfullerene

Ab initio studies on the thermodynamic stability of the icosahedral C60 molecule Buckminsterfullerene

by LÜTHI, H. P, ALMLÖF, J
Published in Chemical physics letters (01.04.1987)

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Similarities and Differences between (C(60))(2)(2-) and (C(59)N)(2) Conformers

Similarities and Differences between (C(60))(2)(2-) and (C(59)N)(2) Conformers

by Lee, K H, Park, S S, Suh, Y, Yamabe, T, Osawa, E, Lüthi, H P, Gutta, P, Lee, C
Published in Journal of the American Chemical Society (07.11.2001)

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trans versus geminal Electron Delocalization in Tetra- and Diethynylethenes: A New Method of Analysis

trans versus geminal Electron Delocalization in Tetra- and Diethynylethenes: A New Method of Analysis

by Bruschi, Maurizio, Giuffreda, Maria Grazia, Lüthi, Hans Peter
Published in Chemistry : a European journal (16.09.2002)

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Through versus Cross Electron Delocalization in Polytriacetylene Oligomers: A Computational Analysis

Through versus Cross Electron Delocalization in Polytriacetylene Oligomers: A Computational Analysis

by Bruschi, Maurizio, Giuffreda, Maria Grazia, Lüthi, Hans Peter
Published in Chemphyschem (11.03.2005)

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