• Title/Summary/Keyword: LI6

Search Result 4,254, Processing Time 0.032 seconds

Structures and Formation Energies of LixC6 (x=1-3) and its Homologues for Lithium Rechargeable Batteries

  • Doh, Chil-Hoon;Han, Byung-Chan;Jin, Bong-Soo;Gu, Hal-Bon
    • Bulletin of the Korean Chemical Society
    • /
    • v.32 no.6
    • /
    • pp.2045-2050
    • /
    • 2011
  • Using first principles density functional theory the formation energies of various binary compounds of lithium graphite and its homologues were calculated. Lithium and graphite react to form $Li_1C_6$ (+141 mV) but not form $LiC_4$ (-143 mV), $LiC_3$ (-247 mV) and $LiC_2$ (-529 mV) because they are less stable than lithium metal itself. Properties of structure and reaction potentials of $C_5B$, $C_5N$ and $B_3N_3$ materials as iso-structural graphite were studied. Boron and nitrogen substituted graphite and boron-nitrogen material as a iso-electronic structured graphitic material have longer graphene layer spacing than that of graphite. The layer spacing of $Li_xC_6$, $Li_xC_5B$, $Li_xC_5N$ materials increased until to x=1, and then decreased until to x=2 and 3. Nevertheless $Li_xB_3N_3$ has opposite tendency of layer spacing variation. Among various lithium compositions of $Li_xC_5B$, $Li_xC_5N$ and $Li_xB_3N_3$, reaction potentials of $Li_xC_5B$ (x=1-3) and $Li_xC_5$ (x=1) from total energy analyses have positive values against lithium deposition.

Enrichment of Lithium Isotope by Novel Ion Exchanger Containing Azacrown Ether as Anchor Group (앵커 그룹으로서 아자크라운 에테르를 포함한 새로운 이온교환체에 의한 리튬 동위원소의 농축)

  • Kim, Dong Won;Lee, Nam-Soo;Jeong, Young Kyu;Ryu, Haiil;Kim, Chang Suk;Kim, Bong Gyun
    • Analytical Science and Technology
    • /
    • v.11 no.4
    • /
    • pp.231-234
    • /
    • 1998
  • Separation factor for $^6Li$ and $^7Li$ has been determined using ion exchange resin having 1,7,13-trioxa-4,10,16-triazacyclooctadecane ($N_3O_3$) as an anchor group. The ion exchange capacity of the $N_3O_3$ ion exchanger was 2.0 meq/g dry resin. The lighter isotope, $^6Li$, is concentrated in the fluid phase, while the heavier isotope, $^7Li$, is enriched in the resin phase. By column chromatography [0.3 cm(I.D)${\times}$30 cm (height)] using 3.0 M ammonium chloride solution as an eluent, single separation factor, ${\alpha}$, 1.018, i.e. $(^7Li/^6Li)_{resin}/(^7Li/^6Li)_{fluid}$ was obtained by the Glueckauf theory from the elution curve and isotope ratios.

  • PDF

AFM Study on Surface Film Formation on a Graphite Negative Electrode in a $LiPF_6$-based Non-Aqueous Solution (AFM을 이용한 $LiPF_6$를 주성분으로 하는 비수용액중에서의 흑연 음극 표면에 형성되는 피막에 관한 연구)

  • Jeong, Soon-Ki
    • Journal of the Korea Academia-Industrial cooperation Society
    • /
    • v.7 no.6
    • /
    • pp.1313-1318
    • /
    • 2006
  • The mechanism fur the surface film formation was studied by in situ Atomic Force Microscopy (AFM) observation of a highly oriented pyrolytic graphite (HOPG) basal plane surface during cyclic voltammetry at a slow scan-rate of 0.5 mV $s^{-1}$ in 1 moi $dm^{-3}$ (M) $LiPF_6$ dissolved in a mixture of ethylene carbonate (EC) and diethyl carbonate (DEC). Decomposition of the electrolyte solution began at a potential around 2.15 V vs. $Li^+$/Li on step edges. In the potential range 0.95-0.8 V vs. $Li^+$/Li, flat areas (hill-like structures) and large swelling appeared on the surface. It is considered that these two features were formed by the intercalation of solvated lithium ions and their decomposition beneath the surface, respectively. At potentials more negative than 0.80 V vs. $Li^+$/Li, particle-like precipitates appeared on the basal plane surface. After the first cycle, the thickness of the precipitate layer was 30 nm. The precipitates were considered to be decomposition of the lithium salt ($LiPF_6$) and solvent molecules (EC and DEC), and to have an important role in suppressing further solvent decomposition on the basal plane.

  • PDF

The Synthesis of Na0.6Li0.6[Mn0.72Ni0.18Co0.10]O2 and its Electrochemical Performance as Cathode Materials for Li ion Batteries

  • Choi, Mansoo;Jo, In-Ho;Lee, Sang-Hun;Jung, Yang-Il;Moon, Jei-Kwon;Choi, Wang-Kyu
    • Journal of Electrochemical Science and Technology
    • /
    • v.7 no.4
    • /
    • pp.245-250
    • /
    • 2016
  • The layered $Na_{0.6}Li_{0.6}[Mn_{0.72}Ni_{0.18}Co_{0.10}]O_2$ composite with well crystalized and high specific capacity is prepared by molten-salt method and using the substitution of Na for Li-ion battery. The effects of annealing temperature, time, Na contents, and electrochemical performance are investigated. In XRD analysis, the substitution of Na-ion resulted in the P2-$Na_{2/3}MO_2$ structure ($Na_{0.70}MO_{2.05}$), which co-exists in the $Na_{0.6}Li_{0.6}[Mn_{0.72}Ni_{0.18}Co_{0.10}]O_2$ composites. The discharge capacities of cathode materials exhibited $284mAhg^{-1}$ with higher initial coulombic efficiency.

Formation of Mo(NAr)(PMe₃)₂Cl₃and Mo₂(PMe₃)₄Cl₄from Reduction of Mo(NAr)₂Cl₂(DME) with Mg in the Presence of PMe₃[Ar=2,6-diisopropylphenyl]

  • 정건수;박병규;Lee, Soon W.
    • Bulletin of the Korean Chemical Society
    • /
    • v.18 no.2
    • /
    • pp.213-217
    • /
    • 1997
  • Magnesium reduction of Mo(N-C6H3-2,6-i-Pr2)2Cl2(DME) in the presence of trimethylphosphine led to a mixture of Mo(N-C6H3-2,6-i-Pr2)(PMe3)2Cl3, 1, and Mo2(PMe3)4Cl4, 2. In solution 1 is slowly air-oxidized to Mo(N-2,6-i-Pr2-C6H3)(OPMe3)(PMe3)Cl3, 3. 1 is chemically inert to carbon nucleophiles (ZnMe2, ZnEt2, AlMe3, AlEt3, LiCp, NaCp, TlCp, NaCp*, MeMgBr, EtMgBr), oxygen nucleophiles (LiOEt, LiO-i-Pr, LiOPh, LiOSPh), and hydrides (LiBEt3H, LiBEt3D). Crystal data for 1: orthorhombic space group P212121, a=11.312(3) Å, b=11.908(3) Å, c=19.381(6) Å, Z=4, R(wR2)=0.0463 (0.1067). Crystal data for 2: monoclinic space group Cc, a=18.384(3) Å, b=9.181(2) Å, c=19.118(3) Å, b=124.98(1)°, Z=4, R(wR2)=0.0228 (0.0568). Crystal data for 3: orthorhombic space group P212121, a=11.464(1) Å, b=14.081(2) Å, c=16.614(3) Å, Z=4, R(wR2)=0.0394 (0.0923).

Structural Evolution of Layered $Li_{1.2}Ni_{0.2}Mn_{0.6}O_2$ upon Electrochemical Cycling in a Li Rechargeable Battery

  • Hong, Ji-Hyeon;Seo, Dong-Hwa;Kim, Seong-Uk;Gwon, Hyeok-Jo;Park, Yeong-Uk;Gang, Gi-Seok
    • Proceedings of the Materials Research Society of Korea Conference
    • /
    • 2010.05a
    • /
    • pp.37.2-37.2
    • /
    • 2010
  • Recently $Li_{1.2}Ni_{0.2}Mn_{0.6}O_2$ has been consistently examined and investigated by scientists because of its high lithium storage capacity, which exceeds beyond the conventional theoretical capacity based on conventional chemical concepts. Consequently, $Li_{1.2}Ni_{0.2}Mn_{0.6}O_2$ is considered as one of the most promising cathode candidates for next generation in Li rechargeable batteries. Yet the mechanism and the origin of the overcapacity have not been clarified. Previously, many authors have demonstrated simultaneous oxygen evolution during the first delithiation. However, it may only explain the high capacity of the first charge process, and not of the subsequent cycles. In this work, we report a clarified interpretation of the structural evolution of $Li_{1.2}Ni_{0.2}Mn_{0.6}O_2$, which is the key element in understanding its anomalously high capacity. We identify how the structural evolution of $Li_{1.2}Ni_{0.2}Mn_{0.6}O_2$ occurs upon the electrochemical cycling through careful study of electrochemical profiles, ex-situ X-ray diffraction (XRD), HR-TEM, Raman spectroscopy, and first principles calculation. Moreover, we successfully separated the structural change at subsequent cycles (mainly cation rearrangement) from the first charge process (mainly oxygen evolution with Li extraction) by intentionally synthesizing sample with large particle size. Consequently, the intermediate states of structural evolution could be well resolved. All observations made through various tools lead to the result that spinel-like cation arrangement and lithium environment are created and embedded in layered framework during repeated electrochemical cycling.

  • PDF

Study on the prohibition of acupuncture of hapgok (LI4) and samumgyo (SP6) during pregnancy (임신금침혈(姙娠禁鍼穴) 중 합곡(合谷)(LI4), 삼음교(三陰交)(SP6)에 관한 고찰(考察))

  • Lee, Soo-Jin
    • Korean Journal of Acupuncture
    • /
    • v.25 no.1
    • /
    • pp.51-60
    • /
    • 2008
  • Objectives : The aim of this study was to investigate the mechanism and the clinical significance of prohibition of acupuncture of LI4 and SP6 during the period of pregnancy. Methods : It was investigated the prohibition of acupuncture during the period of pregnancy based on the literature reviews. Previous studies identified the acupuncture treatment of animal and clinical studies during the period of pregnancy and labor in China Academic Journal(CAJ). These papers were classified and investigated to clarify the rationale of the prohibition of acupuncture during the period of pregnancy. Results and Conclusions : The contraindicated points during the period of pregnancy are Hapgok (LI4), Samumgyo (SP6), Songmun (CV5), Kwanwon (CV4), Sosang (LU11), Chium (BL67), Kollyun (BL60). The uterine contraction can be induced by the stimuli of Hapgok (LI4) via endocrine system and Samumgyo (SP6) via nervous system. Both Hapgok (LI4) and Samumgyo (SP6) also can be used in various diseases such as induction of abortion, facilitation of parturition, stabilization of embryos, cross birth and so on.

  • PDF

Local Environments of Li in the Interlayer of Clay Minerals at Room and High Temperatures (상온 및 고온에서 점토광물 층간의 Li 환경)

  • Kim, Yeong-Kyoo;Lee, Ji-Eun
    • Journal of the Mineralogical Society of Korea
    • /
    • v.20 no.3
    • /
    • pp.193-201
    • /
    • 2007
  • We used $^6Li$ and $^7Li$ MAS NMR to investigate the fate and local environments of Li in the interlayer of clay minerals such as hectorite, Woming-montmorillonite, beidellite, and lepidollite at room and high ($250^{\circ}C$) temperature. Although $^6Li$ NMR spectra show narrower peaks than those of $^7Li$ NMR, S/N ratio is low and there are no obvious differences in chemical shifts suggesting that it is difficult to apply $^6Li$ NMR to have information on the local environments of Li in the clay interlayers. $^7Li$ NMR spectra, however, show changes in the peak width and quadrupole patterns providing information on the local environments of Li in the interlayer even though changes in the chemical shift are not observed. In montmorillonite, two different local environments of Li are observed; one has a narrow peak with typical quadrupole patterns whereas another has a broad peak without those of the patterns. Changes in the peak width is also observed from broad to narrow in the $^7Li$ NMR spectra for beidellite but not for hectorite at high temperature. Our results suggest that the peak width change in the broad peak is attributed to the coordination changes in the water molecules around Li which is tightly bonded on the basal oxygen of Si tetrahedra as inner-sphere complexes. The narrow peak in montmorillnoite can be assigned to the Li bended as outer-sphere complexes.

Temperature Characteristics of Elastic Surface Wave (탄성표면파의 온도특성)

  • 김종상
    • Journal of the Korean Institute of Telematics and Electronics
    • /
    • v.10 no.3
    • /
    • pp.53-60
    • /
    • 1973
  • Calculations of the temperature coefficients of the elastic surface wave velocity and delay time were performed for the propagation along the X axis of rotated Y cut plane of the LiNbO3 and LiTaO3. Measurements of the temperature dependence of delay time of the elastic surface wave were also performed for the propagation along the X axis of a 130" rotated Y cut plane of the LiNb03 at the temperature range from liquid He to room temperature. Experimental value 70$\times$10-6/$^{\circ}C$ of the temperature coefficient of the delay time of the elastic surface wave agrees well with the calculated value 72.7$\times$10-a/$^{\circ}C$. The temperature coefficient of delay time of elastic surface wave propagating along the X axis of a 130$^{\circ}$ rotated Y cut plane o( the LiNbO3 is approximately 16$\times$10-6/$^{\circ}C$ at the near temperature of liquid He.d He.

  • PDF

Electrochemical Properties of Li[Ni0.2Li0.2Mn0.6]O2 by Microwave-assisted Sol-gel Method

  • Park, Yong-Joon;Kim, Seuk-Buom
    • Transactions on Electrical and Electronic Materials
    • /
    • v.10 no.3
    • /
    • pp.102-105
    • /
    • 2009
  • $Li[Ni_{0.2}Li_{0.2}Mn_{0.6}]O_2$ cathode materials have been synthesized by a microwave-assisted sol-gel method. The structure and electrochemical properties of $Li[Ni_{0.2}Li_{0.2}Mn_{0.6}]O_2$ were studied by X-ray difftactometry (XRD), scanning electron microscopy (SEM) and charge-discharge cycler. The powder prepared by microwave assisted sol-gel method showed good crystallinity and well-defined facet shapes. The $Li[Ni_{0.2}Li_{0.2}Mn_{0.6}]O_2$ electrode delivered a high discharge capacity of 230 $mAhg^{-1}$ at the specific current of 40 $mAg^{-1}$ (0.2 C rate) in the voltage range of 2.0${\sim}$4.8 V. About 60 % of the discharge capacity measured at 0.2 Crate (140 $mAhg^{-1}$) was maintained at a 6 C (1200 $mAg^{-1}$)rate. The cyclic property was also stable and it did not deteriorated at a high Crate.