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6 research outputs found
First principles calculations of hyperfine fields in the CeIn3 intermetallic compound
Author
Carbonari A.W.
Haas H.
+3 more
Lalic M.V.
Mestnik Filho J.
Saxena R.N.
Publication venue
Publication date
01/01/2001
Field of study
No full text
HZB Repository
Non-collinear spin DFT study of the ground state magnetic structure, optical and electronic properties of the hexagonal LuFeO3 multiferroic
Author
A.F. Lima
A.T. Melo
+33 more
Akbashev
Ambrosch-Draxl
Anisimov
Anisimov
Barth
Bousquet
Czyiyk
D.M.S. Brito
Das
Disseler
Dong
Eerenstein
Han
Holinsworth
Jeong
Kubler
Lima
M.V. Lalic
MacDonald
Moyer
Munoz
Nordstrom
Pavlov
Perdew
Rai
Sjostedt
Spaldin
Suresh
Wang
Wang
Wang
Wang
Ye
Publication venue
'Elsevier BV'
Publication date
Field of study
No full text
Crossref
Structural, electronic and optical characterization of substitutional Ag defect in Li2B4O7 scintillator
Author
A.F. Lima
Ambrosch-Draxl
+32 more
Andersen
Aydin
Bader
Blaha
Brant
Brant
Brant
C. Santos
Corradi
Hohenberg
Kananen
Kelemen
Kohn
Komsa
Komsa
M.V. Lalic
Martienssen
Nakamura
Nayak
Otero-de-la-Roza
Otero-De-La-Roza
Pekpak
Perdew
Rawat
Romet
Sangeeta
Santos
Santos
Senyshyn
Tran
Vohra
Zywietz
Publication venue
'Elsevier BV'
Publication date
Field of study
No full text
Crossref
Electronic structure and optical properties of magnesium tetraborate: An ab initio study
Author
A.F. Lima
Ambrosch-Draxl
+43 more
Andersen
Bader
Bartl
Bass
Bechstedt
Blaha
Doull
Ekdal
Furetta
Haas
Hohenberg
Islam
Kitis
Kohn
Koller
Lima
Lima
Lochab
M.G. Brik
M.V. Lalic
McKeever
Mittani
Ogorodnikov
Passmore
Pekpak
Perdew
Perdew
Prokic
Prokic
Rao
S.O. Souza
Santos
Segall
Singh
Souza
Souza
T.M. Oliveira
Tran
Tran
Wooten
Yukihara
Yukihara
Yukihara
Publication venue
'Elsevier BV'
Publication date
Field of study
No full text
Crossref
Theoretical study of electronic and optical properties of the scheelite MWO4 (M = Ca, Sr or Ba) compounds by applying the modified Becke-Johnson exchange-correlation potential
Author
A.F. Lima
Adachi
+42 more
Ambrosch-Draxl
Anicete-Santos
Benmakhlouf
Blaha
Botella
Cheng
Errandonea
Evarestov
Fujita
Goel
Hohenberg
I.P. Carvalho
Itoh
Ivleva
Jiang
Kamenskikh
Kim
Kohn
Lacomba-Perales
Lacomba-Perales
Lima
M.V. Lalic
MacDonald
Maureraa
Nikl
Oliveira
Perdew
Perdew
Santamaria-Perez
Santos
Schwartz
Shan
Shivakumara
Singh
Sivers
Song
Sousa
Spassky
Tran
Tyagi
Ze-Xu
Zhang
Publication venue
'Elsevier BV'
Publication date
Field of study
No full text
Crossref
A Theoretical Study of 51V Electric Field Gradient Tensors in Pyrovanadates and Metavanadates
Author
A. Michalak
A. Y. H. Lo
+102 more
A.C. Lewandowski
A.D. Becke
A.D. Becke
A.M. Orendt
A.W. Sleight
A.Y.H. Lo
B. Jager
B. Taouk
B. Zhou
B.A. Gee
B.A. Gee
B.D. Jordan
C. Gheorghe
C. Lee
C. Marichal
C.M. Widdifield
C.V. Grant
D. Rehder
D. Stueber
D. Stueber
D. Stueber
D. Stueber
D. Stueber
D.H. Barich
E.V. Murashova
F. Marumo
G. Busca
G. Perez
G. Pistoia
G.D. Andreetti
H. Eckert
H.M. Petrilli
H.N. Ng
J. Davis
J. Livage
J. Livage
J. Skibsted
J. Skibsted
J. V. Hanna
J.C. Bouloux
J.M. Amarilla
J.S. Clawson
K. Hermann
K. Kato
K. Schwarz
K. Schwarz
K.H. Thompson
K.V.R. Chary
L. Truflandier
L. Zhang
L.R. Le Coustumer
L.S. Vorotilova
M. Body
M. Ganne
M. Iglesias
M. Strohmeier
M. Strohmeier
M. Strohmeier
M.J. Frisch
M.J. Willans
M.R. Hansen
M.V. Lalic
N. Das
N. di Fiori
N. Krishnamachari
N. Pooransingh
O.B. Lapina
O.B. Lapina
O.B. Lapina
O.G. Karpov
P. Blaha
P. Pyykko
P. Ravindran
P.J. Hagrman
P.K.L. Au
P.L. Bryant
P.R. Bodart
R. Gopal
R. Gopal
R. Gopal
R. Laskowski
R. Siegel
R. W. Schurko
R.A.B. Devine
R.D. Shannon
R.W.G. Wyckoff
S. Grasser
S. Hayashi
S. Huzinaga
S.I. Andronenko
S.J. Clark
T. Blasco
T. Blasco
T. Blasco
T. Yao
U.G. Nielsen
U.G. Nielsen
U.G. Nielsen
U.G. Nielsen
U.G. Nielsen
V.K. Trunov
W.L. Huang
Publication venue
'Springer Science and Business Media LLC'
Publication date
Field of study
No full text
Crossref