Li+−(Diglyme)2 and LiClO4−Diglyme Complexes: Barriers to Lithium Ion Migration
Baboul, Anwar G, Redfern, Paul C, Sutjianto, Amin, Curtiss, Larry A
Published in Journal of the American Chemical Society (11.08.1999)
Published in Journal of the American Chemical Society (11.08.1999)
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Journal Article
Gaussian-3 theory using coupled cluster energies
Curtiss, Larry A, Raghavachari, Krishnan, Redfern, Paul C, Baboul, Anwar G, Pople, John A
Published in Chemical physics letters (26.11.1999)
Published in Chemical physics letters (26.11.1999)
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Journal Article
Nature of the Transition Structure for Alkene Epoxidation by Peroxyformic Acid, Dioxirane, and Dimethyldioxirane: A Comparison of B3LYP Density Functional Theory with Higher Computational Levels
Bach, Robert D, Glukhovtsev, Mikhail N, Gonzalez, Carlos, Marquez, Manuel, Estévez, Carlos M, Baboul, Anwar G, Schlegel, H. Bernhard
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (21.08.1997)
Published in The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory (21.08.1997)
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Journal Article
Early Transition Metal Complexes Containing 1,2,4-Triazolato and Tetrazolato Ligands: Synthesis, Structure, and Molecular Orbital Studies
Yélamos, Carlos, Gust, Karl R, Baboul, Anwar G, Heeg, Mary Jane, Schlegel, H. Bernhard, Winter, Charles H
Published in Inorganic chemistry (03.12.2001)
Published in Inorganic chemistry (03.12.2001)
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Journal Article
Structures and Energetics of Some Potential Intermediates in Titanium Nitride Chemical Vapor Deposition: TiCl m (NH2) n , TiCl m (NH2) n NH, and TiCl m (NH2) n N. An ab Initio Molecular Orbital Study
Baboul, Anwar G, Schlegel, H. Bernhard
Published in The journal of physical chemistry. B (25.06.1998)
Published in The journal of physical chemistry. B (25.06.1998)
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Journal Article
Surprising Titanium Complexes Bearing η2-Pyrazolato Ligands: Synthesis, Structure, and Molecular Orbital Studies
Guzei, Ilia A, Baboul, Anwar G, Yap, Glenn P. A, Rheingold, Arnold L, Schlegel, H. Bernhard, Winter, Charles H
Published in Journal of the American Chemical Society (09.04.1997)
Published in Journal of the American Chemical Society (09.04.1997)
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Journal Article
Structures and Energetics of Some Potential Intermediates in Titanium Nitride Chemical Vapor Deposition: TiClm(NH2)n, TiClm(NH2)nNH, and TiClm(NH2)nN. An ab Initio Molecular Orbital Study
BABOUL, Anwar G., SCHLEGEL, H. Bernhard
Published in The journal of physical chemistry. B (25.06.1998)
Published in The journal of physical chemistry. B (25.06.1998)
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Journal Article
Li + −(Diglyme) 2 and LiClO 4 −Diglyme Complexes: Barriers to Lithium Ion Migration
Baboul, Anwar G., Redfern, Paul C., Sutjianto, Amin, Curtiss, Larry A.
Published in Journal of the American Chemical Society (01.08.1999)
Published in Journal of the American Chemical Society (01.08.1999)
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Journal Article
Surprising Titanium Complexes Bearing η 2 -Pyrazolato Ligands: Synthesis, Structure, and Molecular Orbital Studies
Guzei, Ilia A., Baboul, Anwar G., Yap, Glenn P. A., Rheingold, Arnold L., Schlegel, H. Bernhard, Winter, Charles H.
Published in Journal of the American Chemical Society (01.04.1997)
Published in Journal of the American Chemical Society (01.04.1997)
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Journal Article