Quelch, Geoffrey E.: search on Z-Library

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1

The titane molecule (TiH4): Equilibrium geometry, infrared and Raman spectra of the first spectroscopically characterized transition metal tetrahydride

Thomas, J. Russell, Quelch, Geoffrey E., Seidl, Edward T., Schaefer, Henry F.

Journal:

The Journal of Chemical Physics

Year:

1992

Language:

english

File:

PDF, 618 KB

english, 1992

2

The HO 2+ ion

Quelch, Geoffrey E., Xie, Yaoming, Yates, Brian F., Yamaguchi, Yukio, Schaefer, Henry F.

Journal:

Molecular Physics

Year:

1989

Language:

english

File:

PDF, 864 KB

english, 1989

3

Is there a potential minimum corresponding to singlet methylnitrene? A study of the CH3N to CH2NH rearrangement on the lowest singlet state potential energy hypersurface

Richards, Claude, Meredith, Cynthia, Kim, Seung-Joon, Quelch, Geoffrey E., Schaefer, Henry F.

Journal:

The Journal of Chemical Physics

Year:

1994

Language:

english

File:

PDF, 939 KB

english, 1994

4

Octahedral and Prismatic Isomers of CrF6: Energies and Vibrational Frequencies

Marsden, Colin J., Moncrieff, David, Quelch, Geoffrey E.

Journal:

Journal of Physical Chemistry

Year:

1994

Language:

english

File:

PDF, 848 KB

english, 1994

5

Concerning the interaction of atomic silver with a silicon monoxide ligand

Quelch, Geoffrey E., Grev, Roger S., Schaefer, Henry F.

Journal:

Journal of the Chemical Society Chemical Communications

Year:

1989

Language:

english

File:

PDF, 282 KB

english, 1989

6

Ab initio CI calculations on the ionized states of [Co2(η5-C5H5)2(CO)2] and [Co2(η5-C5H5)2(NO)2]

Geoffrey E. Quelch, Ian H. Hillier

Journal:

Chemical Physics Letters

Year:

1988

Language:

english

File:

PDF, 394 KB

english, 1988

7

Resolution of a long-standing problem in elemental sulfur chemistry: a theoretical study of tetrasulfur

Quelch, Geoffrey E., Schaefer, Henry F., Marsden, Colin J.

Journal:

Journal of the American Chemical Society

Year:

1990

Language:

english

File:

PDF, 2.08 MB

english, 1990

8

The unknown unsubstituted tetrazines: 1,2,3,4-tetrazine and 1,2,3,5-tetrazine

Thomas, J. Russell, Quelch, Geoffrey E., Schaefer, Henry F.

Journal:

Journal of Organic Chemistry

Year:

1991

Language:

english

File:

PDF, 602 KB

english, 1991

9

Aspects of the reaction mechanism of ethane combustion. Conformations of the ethylperoxy radical

Quelch, Geoffrey E., Gallo, Mary M., Schaefer, Henry F.

Journal:

Journal of the American Chemical Society

Year:

1992

Language:

english

File:

PDF, 1.17 MB

english, 1992

10

The S32+ dication: the first 16-valence-electron triatomic with an equilateral triangle triplet ground state?

Marsden, Colin J., Quelch, Geoffrey E., Schaefer, Henry F.

Journal:

Journal of the American Chemical Society

Year:

1992

Language:

english

File:

PDF, 842 KB

english, 1992

11

An ab initio molecular orbital study of the structure and vibrational frequencies of CH3MgH

Quelch, Geoffrey E., Hillier, Ian H.

Journal:

Journal of the Chemical Society Faraday Transactions 2

Year:

1987

Language:

english

File:

PDF, 350 KB

english, 1987

12

Ab initio study of the photoelectron spectra and bonding in [Ru2(O2CH)4] and [Ru2(O2CH)4(NO)2]: the effect of axial ligands on metal-metal interactions

Quelch, Geoffrey E., Hillier, Ian H., Guest, Martyn F.

Journal:

Journal of the Chemical Society Dalton Transactions

Year:

1990

Language:

english

File:

PDF, 948 KB

english, 1990

13

Normal-Valent ClO n X Compounds for n = 2, 3 and X = Cl, H: An MCSCF Investigation

Phillips, Donald H., Quelch, Geoffrey E.

Journal:

Journal of Physical Chemistry

Year:

1996

Language:

english

File:

PDF, 243 KB

english, 1996

14

An ab initio molecular orbital study of the structure and vibrational frequencies of methyl copper hydride, CH3CuH

Geoffrey E. Quelch, Ian H. Hillier

Journal:

Chemical Physics

Year:

1988

Language:

english

File:

PDF, 407 KB

english, 1988

15

How stable is cyclobutyne? The activation energy for the unimolecular rearrangement to butatriene

Carlson, Heather A., Quelch, Geoffrey E., Schaefer, Henry F.

Journal:

Journal of the American Chemical Society

Year:

1992

Language:

english

File:

PDF, 615 KB

english, 1992

16

An experimental and theoretical study of the ionization energies of Ru2(O2CCF3)4 and Ru2(O2CCF3)4(NO)2

David L. Clark, Jennifer C. Green, Catherine M. Redfern, Geoffrey E. Quelch, Ian H. Hillier, Martyn F. Guest

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 327 KB

english, 1989

17

Cyclopentadienylidenecarbene: a stable isomer of o-benzyne?

Burton, Neil A., Quelch, Geoffrey E., Gallo, Mary M., Schaefer, Henry F.

Journal:

Journal of the American Chemical Society

Year:

1991

Language:

english

File:

PDF, 745 KB

english, 1991

18

Peroxy and cyclic isomers of NO2 and NO−2

Meredith, Cynthia, Davy, Randall D., Quelch, Geoffrey E., Schaefer, Henry F.

Journal:

The Journal of Chemical Physics

Year:

1991

Language:

english

File:

PDF, 1.16 MB

english, 1991

19

Aspects of the Reaction Mechanism of Ethane Combustion. 2. Nature of the Intramolecular Hydrogen Transfer

Quelch, Geoffrey E., Gallo, Mary M., Shen, Mingzuo, Xie, Yaoming, Schaefer, Henry F., Moncrieff, David

Journal:

Journal of the American Chemical Society

Year:

1994

Language:

english

File:

PDF, 1.17 MB

english, 1994

20

An ab initio molecular-orbital study of the structure and spectroscopic properties of CH3AlH

Quelch, Geoffrey E., Hillier, Ian H.

Journal:

Journal of the Chemical Society Faraday Transactions 2

Year:

1987

Language:

english

File:

PDF, 505 KB

english, 1987

21

Investigation of XNO and XON (where X=Cl or Br) and their protonated isomers

Meredith, Cynthia, Quelch, Geoffrey E., Schaefer, Henry F.

Journal:

The Journal of Chemical Physics

Year:

1992

Language:

english

File:

PDF, 1.03 MB

english, 1992

22

Open-chain and cyclic protonated ozone: the ground-state potential-energy hypersurface

Meredith, Cynthia, Quelch, Geoffrey E., Schaefer, Henry F.

Journal:

Journal of the American Chemical Society

Year:

1991

Language:

english

File:

PDF, 996 KB

english, 1991

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