Search Results - "Damrauer, Robert"

Computational Studies of Carbodiimide Rings by Damrauer, Robert, Lin, Hai, Damrauer, Niels H

“…Computational studies of alicyclic carbodiimides (RNCNR) (rings five through twelve) at the MP2/6-31G­(d,p)//MP2/6-31G­(d,p) level of theory were conducted…”
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Computational studies of silanediimine rings by Damrauer, Robert

“…This paper investigates how a series of alicyclic silanediimine transition states undergo stereoisomerization to either their enantiomeric or diastereomeric…”
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Computational Studies of Aliphatic Amine Basicity by Caskey, Douglas C, Damrauer, Robert, McGoff, Damian

“…Computational studies have been used to examine the structural and energetic effects of adding small numbers of water molecules to ammonia, methylamine,…”
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Chemistry and Thermochemistry of Silicon-Containing Anions in the Gas Phase by Damrauer, Robert, Hankin, Joseph A

“…Silicon anions studied in the gas-phase can be used to obtain a variety a basic thermochemical properties. The stability and reactivity of unusual…”
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Interactions of Tetrahedrane and Tetrasilatetrahedrane with CH2 and SiH2: A Computational Study by Damrauer, Robert

“…Ab initio exploration of the interactions of triplet and singlet methylene (CH2) and singlet silylene (SiH2) with both tetrahedrane and tetrasilatetrahedrane…”
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Interactions of Tetrahedrane and Tetrasilatetrahedrane with CH 2 and SiH 2 : A Computational Study by Damrauer, Robert

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Studies of 1,2-Dihalo Shifts in Carbon–Carbon, Carbon–Silicon, and Silicon–Silicon Systems: A Computational Study by Damrauer, Robert, Stanton, John F.

“…Ab initio exploration of the two unusual silicon-containing transition-state structures has been carried out to determine their bonding characteristics. Each…”
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Dissolving Metal Reduction of Acetylenes:  A Computational Study by Damrauer, Robert

“…The two-electron, two-proton reduction of alkynes to trans-alkenes has been studied computationally using the polarizable continuum regime to model liquid…”
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Activation of P 4 by Singlet Silylene (SiH 2 ): A Computational Study by Damrauer, Robert, Pusede, Sally E.

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Preparation and NMR studies of pentacoordinated silicon anions by Damrauer, Robert, Danahey, Stephen E

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Organometallic Chemistry in the Flowing Afterglow:  A Review by Damrauer, Robert

“…The flowing afterglow technique, among the various mass spectroscopic methods that have been used to study ions and ion−molecule reactions in the gas phase,…”
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Gas-phase and computational studies of pentacoordinate silicon by Damrauer, Robert, Burggraf, Larry W, Davis, Larry P, Gordon, Mark S

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Gas-phase chemistry of HSiS- and HSiNH-: ions related to silathioformaldehyde and the silaazomethine of formaldehyde by Damrauer, Robert, Krempp, Michele, O'Hair, Richard A. J

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Synthetic and Computational Studies of Silametacyclophanes: Macrocyclic Cage Compounds by Kwochka, William R, Damrauer, Robert, Schmidt, Michael W, Gordon, Mark S

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Synthesis of fluorosilanes from chlorosilanes: the use of hexafluorosilicates by Damrauer, Robert, Simon, Roger A, Kanner, Bernard

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Singlet and Triplet Methylene (CH 2 ) Plus P 4 : A Computational Study by Damrauer, Robert, Pusede, Sally E., Staton, Grant M.

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Singlet and Triplet Methylene (CH2) Plus P4: A Computational Study by Damrauer, Robert, Pusede, Sally E, Staton, Grant M

“…Ab initio studies of the interaction of singlet and triplet methylene with tetrahedral P4 (white phosphorus) are reported in which singlet methylene “reacts”,…”
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Ions Related to Silynes and Disilynes: Computational Studies by Damrauer, Robert, Noble, Anna Louise

“…Ab initio computational studies of two series of silicon-containing compounds related to disilyne and silyne, HSiSiH and HSiCH, have been carried out. Studies…”
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Synthesis and structure of silicon-containing cage molecules by Damrauer, Robert, Hankin, Joseph A., Haltiwanger, R. Curtis

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Computational Studies of Aliphatic Alcohol Acidity by Damrauer, Robert

“…Computational studies have been used to examine the structural and energetic effects of adding small numbers of water molecules to methanol, tert-butyl…”
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