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23 research outputs found
Conformations of 1,2,4,6-Tetrathiepane
Author
D.F. Bocian
E.L. Eliel
+10 more
F. Jensen
F.A.L. Anet
J. Diller
J. Sandstrom
J.B. Hendrickson
K.B. Wiberg
P.C. Hariharan
R.S. Grev
V. Elser
W.J. Hehre
Publication venue
'Springer Science and Business Media LLC'
Publication date
01/01/2004
Field of study
No full text
Crossref
Ab Initio Study of Non-Peptidic Antihypertensives
Author
Binkley J.S.
Chin H.L.
+15 more
Gordon M.S.
Gordon M.S.
Hariharan P.C.
Krovat E.M.
Lindgren B.R.
McAreavey D.
Ondetti M.A.
Peng C.
Pietro W.J.
Sealey J.E.
Slurarchyk W.A.
Spyroulias G.A.
Vallotten M.B.
Wong P.C.
Yadav A.
Publication venue
'Wiley'
Publication date
Field of study
No full text
Crossref
Study of the electronic structure of M(CO)5Cl complexes (M = Mn, Re) using X-ray spectroscopy and density-functional theory
Author
A. T. Shuvaev
A.D. Becke
+28 more
A.T. Shuvaev
B.R. Higginson
C. Furlani
C. Lee
D.L. Lichtenberger
F.A. Cotton
G.A. Petersson
G.P. Ceasar
I. A. Zarubin
I.A. Zarubin
J.A. Connor
M.A. Blokhin
M.B. Hall
M.J. Frisch
M.S. Gordon
P.C. Hariharan
P.C. Hariharan
P.J. Hay
S.C. Avanzino
V. G. Vlasenko
V.G. Vlasenko
V.G. Vlasenko
V.I. Nefedov
V.N. Nefedov
W.H. Richardson
W.J. Hehre
W.R. Wadt
Y.F. Hu
Publication venue
'Allerton Press'
Publication date
Field of study
No full text
Crossref
On the barrier and nature of [1.2]-hydrogen migrations in HCN/HNC and their cation radicals
Author
C. Møller
C.F. Pau
+12 more
G. Frenking
G. Frenking
H. Schwarz
H.F. Schaefer III
J.A. Pople
J.P. Ferris
M.J.D. Powell
P. Pulay
P.C. Hariharan
W. Koch
W.J. Hehre
Y. Osamura
Publication venue
'Springer Science and Business Media LLC'
Publication date
Field of study
No full text
Crossref
An Ab Initio Study of At 2
Author
Areavey D.Mc.
Binkley J.S.
+39 more
Breneman C.M.
Chiu A.T.
Csikos T.
Deraet M.
Ditchfield R.
Dittus J.
Frisch M.J.
Frisch M.J.
Gendron L.
Gordon M.S.
Gordon M.S.
Hariharan P.C.
Hariharan P.C.
Hehre W.J.
Horiuchi M.
Jain S.
Kambayashi Y.
Laflamme L.
Lindman S.
Mukoyama M.
Ondetti M.A.
Ondetti M.A.
Ondetti M.A.
Patchett A.
Peitsch M.C.
Peitsch M.C.
Peitsch M.C.
Peitsch M.C.
Peng C.
Peng C.
Pietro W.J.
Pulakat L.
Rosenstrom U.
Schwede T.
Turner C.A.
Vallotten M.B.
Waeber B.
Wexler R.R.
Yadav A.
Publication venue
'Wiley'
Publication date
Field of study
No full text
Crossref
Theoretical study on the relationship between the molecular structure and corrosion inhibition efficiency of long alkyl side chain acetamide and isoxazolidine derivatives
Author
A. Frisch
A. Yıldırım
+45 more
A.B. Ahmed
A.K. Jeewandara
C.O. Wilson
C.R. Zhang
E.E. Ebenso
E.E. Ebenso
E.S.H.E. Ashry
F. Kandemirli
G. Avila
G. Gece
H. Cheng
H. Cheng
H. Cheng
H. Ju
I. Ahamad
I. Lukovits
J.M. Roque
J.P. Abraham
K.F. Khaled
K.F. Khaled
M. Abdallah
M. Ajmal
M. Karelson
M.J. Frisch
M.J. Frisch
M.S. Gordon
N. Hackerman
P. Hohenberg
P.C. Hariharan
P.C. Hariharan
R. Ditchfield
R. Sa
R.G. Parr
R.G. Pearson
R.G. Pearson
R.G. Pearson
R.S. Mulliken
S. Martinez
S.A. Ali
S.A. Ali
Sk.A. Al
T. Arslan
V.S. Sastri
V.S. Sastri
W.J. Hehre
Publication venue
'Pleiades Publishing Ltd'
Publication date
Field of study
No full text
Crossref
Electron-positron momentum density in TTF-TCNQ
Author
%T.J. Kistenmacher
Alfred A. Manuel
+25 more
B. Barbiellini
B. Barbiellini
D. Gerola
D.G. Lock
E. Boron-acuteski
J.S. Binkley
K.M. O'Brien
Klaus Bechgaard
L. Hoffmann
L.C. Smedskjaer R. Pankaluoto
L.P. Chan
Ludger Hoffmann
M.J. Cohen
M.J. Puska
P. Coppens
P.C. Hariharan
P.E. Bisson
S. Ishibashi
S. Ishibashi
S. Kagoshima
Shoji Ishibashi
W.D. Grobman
W.J. Hehre
W.J. Hehre
Y.C. Jean
Publication venue
'American Physical Society (APS)'
Publication date
01/01/1997
Field of study
No full text
Crossref
Online Research Database In Technology
Ab Initio and DFT Investigations of the Mechanistic Pathway of Singlet Bromocarbenes Insertion into C-H Bonds of Methane and Ethane
Author
A. Padwa
A.D. Becke
+28 more
A.D. Becke
A.E. Reed
B. Miehlich
C. Gonzalez
C. Lee
C.M. Breneman
D. Becke
E.D. Glendening
E.O. Fischer
G. Schaftenaar
G.S. Hammond
J. Salaun
J.A. Pople
J.E. Baldvin
J.M. Walbrick
K. Fukui
K. Irikura
M. Brookhart
M. Ramalingam
M.K. Gilles
M.M. Franel
N. Russon
P.C. Hariharan
R.C. Dobson
R.D. Bach
R.S. Mulliken
W. Kirmse
W. Von
Publication venue
'Springer Science and Business Media LLC'
Publication date
01/01/2007
Field of study
No full text
Crossref
Anisotropy of long range interactions between linear molecules: H 2
Author
Ad van der Avoird
Berns R.M.
+22 more
Buck U.
Cohen S.
Dalgarno A.
Fred Mulder
Hariharan P.C.
Hirschfelder J.O.
Klein M.L.
Koide A.
LeRoy R.J.
Margenau H.
Mulder F.
Mulder F.
Paul E. S. Wormer
Prather J.L.
Shafer R.
Silvera I.F.
Tsapline B.
Wormer P.E.S.
Wormer P.E.S.
Zandee A.P.L.M.
Zandee L.
Zandee L.
Publication venue
'Informa UK Limited'
Publication date
Field of study
No full text
Crossref
Apoptosis in chronic myeloid leukaemia: normal responses by progenitor cells to growth factor deprivation, X-irradiation and glucocorticoids
Author
Andreef M.
Aulitzky W.E.
+29 more
Barnett M.J.
Bedi A.
Borok R.
Brandt J.E.
Daley G.Q.
Dive C.
Emanuel P.D.
Gharebaghi K.
Gishizky M.L.
Gordon M.Y.
Gordon M.Y.
Gordon M.Y.
Hariharan I.K.
Holdrinet R.S.G.
Korsmeyer S.J.
Koury M.J.
Lepine J.
Lewis J.L.
Mandanas R.A.
Myers CD.
Nowell P.C.
Sachs L.
Santucci M.A.
Singer J.W.
Strife A.
Stryckmans P.
Stryckmans P.A.
Szczylik C
Udomsakdi C
Publication venue
'Wiley'
Publication date
Field of study
No full text
Crossref
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