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7 research outputs found
A study of the relationships between unpaired electron density, spin-density and cumulant matrices
Author
A Torre
A Torre
+39Â more
A Torre
Alicia Torre
AV Luzanov
DA Mazziotti
DA Mazziotti
Diego R. Alcoba
DR Alcoba
DR Alcoba
DR Alcoba
DR Alcoba
EI Proynov
ER Davidson
FE Harris
JE Harriman
JM Herbert
K Takatsuka
K Takatsuka
L Lain
L Lain
L Lain
L Lain
Luis Lain
M Head-Gordon
M Nooijen
MW Schmidt
R Bochicchio
R Pauncz
RC Bochicchio
RC Bochicchio
RC Bochicchio
RC Bochicchio
Roberto C. Bochicchio
SF Vyboishchikov
VN Staroverov
VN Staroverov
VN Staroverov
W Kutnelnigg
W Kutzelnigg
W Kutzelnigg
Publication venue
'Springer Science and Business Media LLC'
Publication date
Field of study
No full text
Crossref
Computational study on chain pathways for oxygen atom transfer catalyzed by a methyl(dithiolate) thiorhenium(V) compound
Author
A Ibdah
A Ibdah
+42Â more
A Neuhaus
AK Rappe
AK Rappe
BG Donoeva
BK Panda
C-C Wang
DC Brower
G Jindal
H So
H Tang
J Cho
J Hall
JH Espenson
JL Smeltz
JL Smeltz
JM Mayer
JS Kanady
K Osz
K Tatsumi
KP Gable
LA Curtiss
LA Curtiss
M Palucki
MJ Vasbinder
MM Najafpour
MS Gordon
MW Schmidt
MW Schmidt
P Basu
P Gonzalez-Navarrete
PJ Hay
PJ Hay
R Hille
R Latifi
R Sarkar
SF Vyboishchikov
SP Visser de
W Ye
X Shan
X-T Zhou
Y Cai
Y Wang
Publication venue
'Springer Science and Business Media LLC'
Publication date
Field of study
No full text
Crossref
Gas-Phase Synthesis of Singly and Multiply Charged Polyoxovanadate Anions Employing Electrospray Ionization and Collision Induced Dissociation
Author
A Fielicke
A Pramann
+61Â more
A Stein
A Walcarius
AM Bittner
B Gologan
C Fleming
CL Hill
CL Hill
D Long
DK Walanda
DK Walanda
DL Long
DL Long
DL Long
DL Long
E Coronado
E Jakubikova
G Santambrogio
G Verbeck
GC Bond
GE Johnson
H Schwarz
HB Wu
HJ Zhai
HJ Zhai
I Muylaert
J Laskin
J Livage
J Livage
J Roithova
JM Clemente-Juan
KA Zemski
KA Zemski
KR Asmis
KR Asmis
KR Asmis
KR Asmis
KS Molek
L Bouhedja
L Chen
L Vila-Nadal
M Engeser
M Foltin
MI Khan
MT Pope
N Dietl
N Steunou
RC Bell
RC Bell
RC Bell
S Ard
S Feyel
S Feyel
S Feyel
S Surnev
S Yin
SF Vyboishchikov
T Douglas
WA Heer de
XH Zhang
Y Hayashi
Y Matsuda
Publication venue
'Springer Science and Business Media LLC'
Publication date
Field of study
No full text
Crossref
B3LYP, M06 and B3PW91 DFT assignment of nd8 metal-bis-(N-heterocyclic carbene) complexes
Author
A Gautier
AE Reed
+68Â more
AJ Arduengo
AR Chianese
AR Chianese
AS McCall
Aymard Didier Tamafo Fouegue
Baruch Ateba Amana
C Boehme
C Elschenbroich
CM Crudden
D Meyer
D Munz
D Munz
D Munz
D Pugh
Désiré Bikele Mama
E Chardon
E Peris
E Poverenov
F Cisnetti
F Shimojo
F Weinhold
FM Bickelhaupt
G Ingrosso
G Schreckenbach
Gaël Mouzong D’ambassa
H Jacobsen
H Lebel
Jean Moto Ongagna
Joseph Zobo Mfomo
JP Perdew
K Kitaura
K Morokuma
K Morokuma
K Ruedenberg
KM Hindi
L Galluzzi
Luc Mbaze Meva’A
M Bayat
M Heckenroth
M Muehlhofer
M Nonnenmacher
M Xiao
MA Taige
MJ Frisch
MK Samantaray
MN Hopkinson
NA Johnson
P Politzer
R Jagadeesan
R Visbal
R Wysokinski
RFW Bader
RG Parr
RG Parr
RG Pearson
S Ahrens
S DÃez-González
SF Vyboishchikov
SP Nolan
T Clark
T Lu
T Strassner
T Ziegler
TJ De Bruin
W Heitler
W Liu
WA Herrmann
WA Herrmann
Publication venue
'Springer Science and Business Media LLC'
Publication date
Field of study
No full text
Crossref
Pure non-local machine-learned density functional theory for electron correlation
Author
A Fabrizio
A Grisafi
+72Â more
A Grisafi
A Hjorth Larsen
AA Auer
AD Becke
AD Becke
AJ Cohen
AJ Cohen
AP Bartók
AP Bartók
AP Bartók
C Bannwarth
C Cave-Ayland
C Schran
D Dragoni
D Marx
DGA Smith
EF Valeev
EJ Baerends
F Brockherde
F Neese
F Weigend
F Weigend
FA Faber
H Jung
HP Cheng
IY Zhang
J Behler
J Schmidt
JC Snyder
JP Perdew
JS Smith
JS Smith
JT Margraf
JT Margraf
JT Margraf
JT Margraf
K Raghavachari
KT Butler
L Cheng
L Li
LO Wagner
M Bogojeski
M Dagrada
M Rupp
M Rupp
M Urban
M Welborn
ME Tuckerman
N Artrith
N Oliphant
N Schuch
O Marsalek
OA von Lilienfeld
P Hohenberg
PO Dral
R Peverati
R Ramakrishnan
RJ Bartlett
RJ Bartlett
RM Parrish
S Grimme
S Naserifar
SF Vyboishchikov
SN Steinmann
T Clark
T Head-Gordon
T Morawietz
T Nudejima
T Spura
V Kapil
VL Deringer
W Kohn
Publication venue
'Springer Science and Business Media LLC'
Publication date
Field of study
No full text
Crossref
cis/trans Coordination in Olefin Metathesis by Static and Molecular Dynamic DFT Calculations
Author
A Aharoni
A Becke
+75Â more
A Ben-Asuly
A Ben-Asuly
A Correa
A Correa
A Fürstner
A Leitgeb
A Poater
A Poater
A Poater
A Poater
A Schäfer
A. Correa
A. Poater
AH Hoveyda
C Adlhart
C Adlhart
C Adlhart
C Adlhart
C Adlhart
C Costabile
C Slugovc
CA Urbina-Blanco
CE Diesendruck
CE Diesendruck
CH Suresh
CW Bielawski
D Benitez
D Burtscher
DR Anderson
DR Anderson
E Pump
E. Pump
EF Eide van der
EL Dias
G Occhipinti
GC Vougioukalakis
IC Stewart
J Huang
J Tomasi
JP Perdew
JP Perdew
L Cavallo
L Cavallo
L. Cavallo
M Abbas
M Abbas
M Barbasiewicz
M Barbasiewicz
M Barbasiewicz
M Scholl
M Ulman
MJ Frisch
OM Aagaard
PE Romero
PE Romero
R Credendino
RH Grubbs
RR Schrock
S Fomine
S Prühs
SF Vyboishchikov
ST Nguyen
ST Nguyen
T Kost
T Leininger
T Ung
T Ung
T Weskamp
TM Trnka
U Häussermann
V Barone
W Küchle
X Gstrein
Y Ginzburg
Y Vidavsky
Publication venue
'Springer Science and Business Media LLC'
Publication date
Field of study
No full text
Crossref
Towards a better understanding of alkene metathesis: elucidating the properties of the major metal carbene catalyst types
Author
A Correa
AH Hoveyda
+81Â more
BF Straub
C Adlhart
CH Suresh
Cornelia G. C. E. van Sittert
CP Casey
CP Casey
CP Casey
CP Casey
D Benitez
D Feller
DE Woon
DJ Nelson
E Folga
E Pump
EL Dias
F Bernardi
F Boeda
F Mathey
FN Tebbe
FT Marx
FT Marx
G Klopman
G Occhipinti
G Occhipinti
G Occhipinti
G Scalmani
H Jacobsen
Hermanus C. M. Vosloo
HH Fox
I Fernández
I Fleming
I Fleming
IT Sabbagh
IW Ashworth
J Tomasi
J Tomasi
J-L Hérisson
JB Lee
Jean I. du Toit
JI du Toit
JJ Lippstreu
JP Morgan
JP Perdew
JS Meena
KA Peterson
KH Dötz
KJ Ivin
L Cavallo
M Cossi
M Jordaan
M Tlenkopatchev
MA Tlenkopatchev
MJ Frisch
O Eisenstein
RA Kendall
RH Grubbs
RH Grubbs
RL Lord
RR Schrock
RR Schrock
RR Schrock
RT Morrison
S Beligny
S Fomine
S Fomine
S Fomine
S Gessler
S Grimme
SB Garber
SF Vyboishchikov
ST Nguyen
T Clark
TH Dunning
TH Upton
TJ Katz
V Dragutan
W Janse van Rensburg
WD Wulff
X Solans-Monfort
Y Minenkov
Y Minenkov
Publication venue
'Springer Science and Business Media LLC'
Publication date
Field of study
No full text
Crossref