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13 research outputs found
A new crystal family of GaNGeC quaternary compounds including direct band gap semiconductors and metals
Author
Al Balushi
Blöhl
+36Â more
Butler
Chakrapani
Deng
Deslippe
Fujishima
Giannozzi
Greaves
Grimme
Hill
Huang
Imaoka
Jain
Kresse
Krukau
Lethbridge
Liu
Liu
Lou
Lou
Lou
Lou
Lv
Marmier
Mouhat
Oganov
Pearson
Perdew
Sun
Sun
Wang
Wang
Wang
Yan
Yu
Zener
Zhang
Publication venue
'Royal Society of Chemistry (RSC)'
Publication date
01/01/2021
Field of study
No full text
Crossref
The first evidence of anaerobic CO oxidation coupled with H2 production by a hyperthermophilic archaeon isolated from a deep-sea hydrothermal vent
Author
Baross
Blöhl
+33Â more
Bonch-Osmolovskaya
Burggraf
Cary
Charlou
Daniels
Ensign
Fardeau
Ferry
Fiala
Fukui
Hekinian
Holden
Huber
Kostyukova
Kurr
Lindahl
Marmur
Marmur
Miroshnichenko
Möller-Zinkhan
Pley
Rainey
Sokolova
Sokolova
Stetter
Svetlichny
Svetlitchny
Takai
Uffen
VA Svetlichny
Vorholt
VV Kevbrin
Wolin
Publication venue
'Springer Science and Business Media LLC'
Publication date
Field of study
No full text
Crossref
Strain-induced Dirac cone-like electronic structures and semiconductor–semimetal transition in graphdiyne
Author
Bai
Baughman
+48Â more
Bhattacharya
Blöhl
Castro Neto
Crespi
Diederich
Gang Su
Giannozzi
Gui
Haley
Haley
Hohenberg
Hui-Juan Cui
Kang
Kargarian
Kohn
Kresse
Kresse
Li
Li
Li
Liu
Long
Lu
Luo
Malko
Marsden
Minot
Monkhorst
Narita
Novoselov
Pellegrino
Pellegrino
Peng
Perdew
Qi
Qian
Qing-Bo Yan
Qing-Rong Zheng
Rocquefelte
Sheng
Sheng
Su
Terrones
Verberck
Wan
Xian-Lei Sheng
Yang
Zhang
Publication venue
'Royal Society of Chemistry (RSC)'
Publication date
01/01/2013
Field of study
No full text
Crossref
New insight into the interaction between divacancy and H/He impurity in Ti 3
Author
Barnes
Barsoum
+50Â more
Barsoum
Barsoum
Blöhl
Bugnet
Canglong Wang
Dahlqvist
Ding
Fu
Gaganidze
Herklotz
Hu
Jitao Liu
Kresse
Kresse
Lei Yang
Li
Liang Huang
Liu
Liu
Liu
Naguib
Naguib
Nappe
Patel
Peng
Pietzka
Qi
Song
Wang
Wang
Wang
Wang
Wang
Whittle
Wilson
Wu
Xiao
Xiao
Xiaolu Zhu
Xu
Yang
Yang
Yinlong Wang
Yoshida
Zhang
Zhang
Zhao
Zhaocang Meng
Zhou
Zhou
Publication venue
'Royal Society of Chemistry (RSC)'
Publication date
01/01/2020
Field of study
No full text
Crossref
First-principles energetics of rare gases incorporation into uranium dioxide
Author
Andersson
Ao
+57Â more
Ao
Ao
Ao
Bader
Ball
Barrett
Bertolus
Bingyun Ao
Blöhl
Brock
Chen
Da Silva
Dabrowski
Desgranges
Dion
Dorado
Dudarev
Freyss
Frost
Garcia
Geng
Grochala
Gryaznov
Haiyan Lu
Higgs
Horlait
Iwasawa
Korzhavyi
Kresse
Li
Li
Liu
Liu
Ma
Moore
Morss
Nerikar
Perdew
Petit
Petit
Petit
Slater
Strach
Sun
Szpunar
Szpunar
Tanaka
Thompson
Tian
Wang
Was
Wen
Yu
Yun
Yun
Zhu
Zinkle
Publication venue
'Elsevier BV'
Publication date
Field of study
No full text
Crossref
First-principles DFT +U calculations on the energetics of Ga in Pu, Pu2O3 and PuO2
Author
Ai
Alexandrov
+58Â more
Amadon
Andersson
Ao
Ao
Ao
Ao
Ao
Atta-Fynn
Bakses
Barin
Baskes
Becker
Berlu
Bingyun Ao
Blöhl
Caciuffo
Clerc
Conradson
Deng
Dinh
Dorado
Dudarev
Freysoldt
Freyss
Fukai
Gorman-Lewis
Gryaznov
Haiyan Lu
Haschke
Hecker
Hernandez
Hernandez
Korzhavyi
Kresse
Li
Lu
Moore
Nelson
Perdew
Petit
Piheng Chen
Pochet
Prodan
Pugmire
Regulski
Robert
Ruizhi Qiu
Sadigh
Schwartz
Shim
Sun
Taylor
Tian
Wang
Wen
Wheeler
Zhang
Zinkle
Publication venue
'Elsevier BV'
Publication date
Field of study
No full text
Crossref
Diamond polytypes under high pressure: A first-principles study
Author
Akahama
Amsler
+75Â more
Andrievski
Blöhl
Boppart
Britun
Britun
Bundy
Chimowa
Erskine
Flores-Livas
Gang Su
Gao
Giannozzi
Godard
Gorogotskaya
Hanand
Hanand
Hanfland
He
He
Heyd
Hill
Hirai
Hui-Juan Cui
Iijima
Irifune
Itoh
Jo
Kresse
Kresse
Kroto
Kurdyumov
Kurdyumov
Langenhorst
Lazzeri
Li
Li
Mao
McLarnan
McLarnan
Miller
Monkhorst
Niu
Novoselov
Occelli
Ohfuji
Ownby
Ownby
Pan
Perdew
Perdew
Phelps
Qing-Bo Yan
Qing-Rong Zheng
Raffy
Sharma
Smith
Solin
Spear
Tanigaki
Tian
Umemoto
Utsumi
Walter
Wang
Wang
Watanabe
Wen
Wu
Xian-Lei Sheng
Zhao
Zhao
Zhen-Gang Zhu
Zhou
Zhu
Zhu
Publication venue
'Elsevier BV'
Publication date
Field of study
No full text
Crossref
Synthesis and Phase Width of Quaternary Selenides Pb 4
Author
Agaev K. A.
Altermatt U. D.
+39Â more
Andersen O. K.
Berlepsch P.
Blöhl P. E.
Born L.
Chung D.-Y.
Derakhshan S.
Dronskowski R.
Eddike D.
Edenharter A.
Emirdag-Eanes M.
Gulay L. D.
Hsu K. F.
Jepsen O.
Kanatzidis M. G.
Kraemer V.
Kraemer V.
Kraemer V.
Lebas G.
Matzat E.
Nakajima S.
Nuffield E. W.
Olsen L. A.
Osamura K.
Rowe D. M.
Seung-Am C.
Shannon R. D.
Skowron A.
Skowron A.
Skowron A.
Skowron A.
Skowron A.
Skowron A.
Skriver H. L.
Takéuchi Y.
Takéuchi Y.
van Barth U.
Wang K.-C.
Weitz G.
Zhang Y. G.
Publication venue
'American Chemical Society (ACS)'
Publication date
Field of study
No full text
Crossref
Uniformly Wetting Deposition of Co Atoms on MoS 2
Author
Ataca C.
Ataca C.
+50Â more
Auwarter W.
Blöhl P. E.
Brandbyge M.
Cao C.
Chen J. R.
Cheng Y. C.
Coleman J. N.
Dash S. P.
Gong C.
Grimme S. S.
Henkelman G.
Jinlan Wang
Johari P.
Katsnelson M. I.
Komsa H.-P.
Kresse G.
Kresse G.
Li L.
Li Y.
Liu X.
Ma Y.
Mak K. F.
Mak K. F.
Manna P. K.
Meir Y.
Mishra R.
Nair R. R.
Novoselov K. S.
Novoselov K. S.
Perdew J. P.
Prasai D.
Qian Chen
Qiu H.
Radisavljevic B.
Radisavljevic B.
Ramasubramaniam A.
Runze Li
Schmidt G.
Shen L.
Shijun Yuan
Surwade S. P.
Wang Q. H.
White R. M.
Xiao D.
Yakobson B. I.
Yazyev O. V.
Yixin Ouyang
Zeng H.
Zhang Z. H.
Zhao J.
Publication venue
'American Chemical Society (ACS)'
Publication date
Field of study
No full text
Crossref
Charge Transfer between Metal Clusters and Growing Carbon Structures in Chirality-Controlled Single-Walled Carbon Nanotube Growth
Author
Anisimov A. S.
Bachilo S. M.
+50Â more
Bader R. F.
Becke A. D.
Blöhl P. E.
Borjesson A.
Brinkmann G.
Charlier J. C.
Chiang W. H.
Ciuparu D.
Ding F.
Ding F.
Ding L.
Fukui K.
Fukui K.
Helveg S.
Henkelman G.
Hofmann S.
Hossain M. Z.
Hubig S. M.
Irle S.
Kresse G.
Kresse G.
Kresse G.
Kumeda Y.
Kwon Y. K.
Lair S. L.
Lee Y. H.
Li X. L.
Lin M.
Mary B. Chan-Park
Nasibulin A. G.
Ohta Y.
Page A. J.
Perdew J. P.
Qiang Wang
Reich S.
Reich S.
Sanville E.
Savin A.
Sharma R.
Shuo-Wang Yang
Wang Q.
Wang Q. A.
Yanhui Yang
Yao Y. G.
Yoshida H.
Yu X. C.
Yuan Chen
Zhang Y.
Zhu W. M.
Zhu W. M.
Publication venue
'American Chemical Society (ACS)'
Publication date
Field of study
No full text
Crossref
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