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000828900 1001_ $$0P:(DE-HGF)0$$aSakai, Yuki$$b0
000828900 245__ $$aA-Site and B-Site Charge Orderings in an s–d Level Controlled Perovskite Oxide PbCoO $_{3}$
000828900 260__ $$aWashington, DC$$bAmerican Chemical Society$$c2017
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000828900 520__ $$aPerovskite PbCoO3 synthesized at 12 GPa was found to have an unusual charge distribution of Pb2+Pb4+3Co2+2Co3+2O12 with charge orderings in both the A and B sites of perovskite ABO3. Comprehensive studies using density functional theory (DFT) calculation, electron diffraction (ED), synchrotron X-ray diffraction (SXRD), neutron powder diffraction (NPD), hard X-ray photoemission spectroscopy (HAXPES), soft X-ray absorption spectroscopy (XAS), and measurements of specific heat as well as magnetic and electrical properties provide evidence of lead ion and cobalt ion charge ordering leading to Pb2+Pb4+3Co2+2Co3+2O12 quadruple perovskite structure. It is shown that the average valence distribution of Pb3.5+Co2.5+O3 between Pb3+Cr3+O3 and Pb4+Ni2+O3 can be stabilized by tuning the energy levels of Pb 6s and transition metal 3d orbitals.
000828900 536__ $$0G:(DE-HGF)POF3-142$$a142 - Controlling Spin-Based Phenomena (POF3-142)$$cPOF3-142$$fPOF III$$x0
000828900 536__ $$0G:(DE-Juel1)jiff38_20090701$$aAb initio study of novel multiferroic materials (jiff38_20090701)$$cjiff38_20090701$$fAb initio study of novel multiferroic materials$$x1
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000828900 7001_ $$0P:(DE-HGF)0$$aYang, Junye$$b1
000828900 7001_ $$0P:(DE-HGF)0$$aYu, Runze$$b2
000828900 7001_ $$0P:(DE-HGF)0$$aHojo, Hajime$$b3
000828900 7001_ $$00000-0003-2340-131X$$aYamada, Ikuya$$b4
000828900 7001_ $$0P:(DE-HGF)0$$aMiao, Ping$$b5
000828900 7001_ $$0P:(DE-HGF)0$$aLee, Sanghyun$$b6
000828900 7001_ $$0P:(DE-HGF)0$$aTorii, Shuki$$b7
000828900 7001_ $$0P:(DE-HGF)0$$aKamiyama, Takashi$$b8
000828900 7001_ $$0P:(DE-Juel1)130799$$aLežaić, Marjana$$b9
000828900 7001_ $$0P:(DE-Juel1)130545$$aBihlmayer, Gustav$$b10
000828900 7001_ $$0P:(DE-HGF)0$$aMizumaki, Masaichiro$$b11
000828900 7001_ $$0P:(DE-HGF)0$$aKomiyama, Jun$$b12
000828900 7001_ $$0P:(DE-HGF)0$$aMizokawa, Takashi$$b13
000828900 7001_ $$0P:(DE-HGF)0$$aYamamoto, Hajime$$b14
000828900 7001_ $$0P:(DE-HGF)0$$aNishikubo, Takumi$$b15
000828900 7001_ $$0P:(DE-HGF)0$$aHattori, Yuichiro$$b16
000828900 7001_ $$0P:(DE-HGF)0$$aOka, Kengo$$b17
000828900 7001_ $$0P:(DE-HGF)0$$aYin, Yunyu$$b18
000828900 7001_ $$0P:(DE-HGF)0$$aDai, Jianhong$$b19
000828900 7001_ $$0P:(DE-HGF)0$$aLi, Wenmin$$b20
000828900 7001_ $$0P:(DE-HGF)0$$aUeda, Shigenori$$b21
000828900 7001_ $$0P:(DE-HGF)0$$aAimi, Akihisa$$b22
000828900 7001_ $$0P:(DE-HGF)0$$aMori, Daisuke$$b23
000828900 7001_ $$0P:(DE-HGF)0$$aInaguma, Yoshiyuki$$b24
000828900 7001_ $$0P:(DE-HGF)0$$aHu, Zhiwei$$b25
000828900 7001_ $$0P:(DE-HGF)0$$aUozumi, Takayuki$$b26
000828900 7001_ $$0P:(DE-HGF)0$$aJin, Changqing$$b27
000828900 7001_ $$0P:(DE-HGF)0$$aLong, Youwen$$b28
000828900 7001_ $$0P:(DE-HGF)0$$aAzuma, Masaki$$b29$$eCorresponding author
000828900 773__ $$0PERI:(DE-600)1472210-0$$a10.1021/jacs.7b01851$$gVol. 139, no. 12, p. 4574 - 4581$$n12$$p4574 - 4581$$tJournal of the American Chemical Society$$v139$$x1520-5126$$y2017
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