Kitchaev, Daniil A.: search on Z-Library

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1

Non-equilibrium crystallization pathways of manganese oxides in aqueous solution

Sun, Wenhao, Kitchaev, Daniil A., Kramer, Denis, Ceder, Gerbrand

Journal:

Nature Communications

Year:

2019

Language:

english

File:

PDF, 879 KB

english, 2019

2

Reversible Mn2+/Mn4+ double redox in lithium-excess cathode materials

Lee, Jinhyuk, Kitchaev, Daniil A., Kwon, Deok-Hwang, Lee, Chang-Wook, Papp, Joseph K., Liu, Yi-Sheng, Lun, Zhengyan, Clément, Raphaële J., Shi, Tan, McCloskey, Bryan D., Guo, Jinghua, Balasubramanian,

Journal:

Year:

2018

Language:

english

File:

PDF, 14.44 MB

english, 2018

3

Structure and Dynamics of Fluorophosphate Na-Ion Battery Cathodes

Dacek, Stephen T., Richards, William D., Kitchaev, Daniil A., Ceder, Gerbrand

Journal:

Chemistry of Materials

Year:

2016

Language:

english

File:

PDF, 25.51 MB

english, 2016

4

Design principles for high transition metal capacity in disordered rocksalt Li-ion cathodes

Kitchaev, Daniil A., Lun, Zhengyan, Richards, William D., Ji, Huiwen, Clément, Raphaële J., Balasubramanian, Mahalingam, Kwon, Deok-Hwang, Dai, Kehua, Papp, Joseph K., Lei, Teng, McCloskey, Bryan D.,

Journal:

Energy & Environmental Science

Year:

2018

Language:

english

File:

PDF, 6.56 MB

english, 2018

5

Selective brookite polymorph formation related to the amorphous precursor state in TiO2 thin films

Mangum, John S., Agirseven, Okan, Haggerty, James E.S., Perkins, John D., Schelhas, Laura T., Kitchaev, Daniil A., Garten, Lauren M., Ginley, David S., Toney, Michael F., Tate, Janet, Gorman, Brian P.

Journal:

Journal of Non-Crystalline Solids

Year:

2019

Language:

english

File:

PDF, 1001 KB

english, 2019

6

Hidden structural and chemical order controls lithium transport in cation-disordered oxides for rechargeable batteries

Ji, Huiwen, Urban, Alexander, Kitchaev, Daniil A., Kwon, Deok-Hwang, Artrith, Nongnuch, Ophus, Colin, Huang, Wenxuan, Cai, Zijian, Shi, Tan, Kim, Jae Chul, Kim, Haegyeom, Ceder, Gerbrand

Journal:

Nature Communications

Year:

2019

File:

PDF, 1.98 MB

2019

7

Revealing and Rationalizing the Rich Polytypism of Todorokite MnO 2

Hu, Xiaobing, Kitchaev, Daniil A, Wu, Lijun, Zhang, Bingjie, Meng, Qingping, Poyraz, Altug S., Marschilok, Amy C., Takeuchi, Esther S., Takeuchi, Kenneth J., Ceder, Gerbrand, Zhu, Yimei

Journal:

Journal of the American Chemical Society

Year:

2018

Language:

english

File:

PDF, 3.19 MB

english, 2018

8

Understanding crystallization pathways leading to manganese oxide polymorph formation

Chen, Bor-Rong, Sun, Wenhao, Kitchaev, Daniil A., Mangum, John S., Thampy, Vivek, Garten, Lauren M., Ginley, David S., Gorman, Brian P., Stone, Kevin H., Ceder, Gerbrand, Toney, Michael F., Schelhas,

Journal:

Nature Communications

Year:

2018

Language:

english

File:

PDF, 1.30 MB

english, 2018

9

Effect of Fluorination on Lithium Transport and ShortâRange Order in DisorderedâRocksaltâType LithiumâIon Battery Cathodes

Ouyang, Bin, Artrith, Nongnuch, Lun, Zhengyan, Jadidi, Zinab, Kitchaev, Daniil A., Ji, Huiwen, Urban, Alexander, Ceder, Gerbrand

Journal:

Advanced Energy Materials

Year:

2020

Language:

english

File:

PDF, 2.35 MB

english, 2020

10

Non-equilibrium crystallization pathways of manganese oxides in aqueous solution

Sun, Wenhao, Kitchaev, Daniil A., Kramer, Denis, Ceder, Gerbrand

Journal:

Nature Communications

Year:

2019

File:

PDF, 879 KB

2019

11

Understanding Crystallization Pathways of MnOx Polymorph Formation via in-situ X-ray Scattering

Chen, Bor-Rong, Sun, Wenhao, Kitchaev, Daniil A., Mangum, John S., Thampy, Vivek, Garten, Lauren M., Ginley, David G., Gorman, Brian P., Stone, Kevin H., Ceder, Gerbrand, Toney, Michael F., Schelhas,

Journal:

Microscopy and Microanalysis

Year:

2018

Language:

english

File:

PDF, 264 KB

english, 2018

12

Phenomenology of chiral Dzyaloshinskii-Moriya interactions in strained materials

Kitchaev, Daniil A., Beyerlein, Irene J., Van der Ven, Anton

Journal:

Physical Review B

Year:

2018

Language:

english

File:

PDF, 235 KB

english, 2018

13

DNA double-strand breaks induced by high NaCl occur predominantly in gene deserts

Natalia I. Dmitrieva, Kairong Cui, Daniil A. Kitchaev, Keji Zhao and Maurice B. Burg

Journal:

Proceedings of the National Academy of Sciences

Year:

2011

Language:

english

File:

PDF, 1.91 MB

english, 2011

14

Efficient first-principles prediction of solid stability: Towards chemical accuracy

Zhang, Yubo, Kitchaev, Daniil A., Yang, Julia, Chen, Tina, Dacek, Stephen T., Sarmiento-Pérez, Rafael A., Marques, Maguel A. L., Peng, Haowei, Ceder, Gerbrand, Perdew, John P., Sun, Jianwei

Journal:

npj Computational Materials

Year:

2018

Language:

english

File:

PDF, 801 KB

english, 2018

15

[IEEE 2018 IEEE 7th World Conference on Photovoltaic Energy Conversion (WCPEC) (A Joint Conference of 45th IEEE PVSC, 28th PVSEC & 34th EU PVSEC) - Waikoloa Village, HI, USA (2018.6.10-2018.6.15)] 2018 IEEE 7th World Conference on Photovoltaic Energy Conversion (WCPEC) (A Joint Conference of 45th IEEE PVSC, 28th PVSEC & 34th EU PVSEC) - Semiconductor parameter extraction via current-voltage characterization and Bayesian inference methods

Kurchin, Rachel C., Poindexter, Jeremy R., Kitchaev, Daniil, Vahanissi, Ville, Canizo, Carlos del, Zhe, Liu, Laine, Hannu S., Roat, Chris, Levcenco, Sergiu, Ceder, Gerbrand, Buonassisi, Tonio

Year:

2018

Language:

english

File:

PDF, 1.28 MB

english, 2018

16

Thermodynamics of Phase Selection in MnO 2 Framework Structures through Alkali Intercalation and Hydration

Kitchaev, Daniil A., Dacek, Stephen T., Sun, Wenhao, Ceder, Gerbrand

Journal:

Journal of the American Chemical Society

Year:

2017

Language:

english

File:

PDF, 41.42 MB

english, 2017

17

Electrochemical trapping of metastable Mn 3+ ions for activation of MnO 2 oxygen evolution catalysts

Morgan Chan, Zamyla, Kitchaev, Daniil A., Nelson Weker, Johanna, Schnedermann, Christoph, Lim, Kipil, Ceder, Gerbrand, Tumas, William, Toney, Michael F., Nocera, Daniel G.

Journal:

Proceedings of the National Academy of Sciences

Year:

2018

Language:

english

File:

PDF, 1.04 MB

english, 2018

18

Computational Investigation and Experimental Realization of Disordered High-Capacity Li-Ion Cathodes Based on Ni Redox

Ji, Huiwen, Kitchaev, Daniil A., Lun, Zhengyan, Kim, Hyunchul, Foley, Emily, Kwon, Deok-Hwang, Tian, Yaosen, Balasubramanian, Mahalingam, Bianchini, Matteo, Cai, Zijian, Clément, Raphaële J., Kim, Jae

Journal:

Chemistry of Materials

Year:

2019

File:

PDF, 3.82 MB

2019

19

Rationalizing accurate structure prediction in the meta-GGA SCAN functional

Yang, Julia H., Kitchaev, Daniil A., Ceder, Gerbrand

Journal:

Physical Review B

Year:

2019

Language:

english

File:

PDF, 1.20 MB

english, 2019

20

Finding and proving the exact ground state of a generalized Ising model by convex optimization and MAX-SAT

Huang, Wenxuan, Kitchaev, Daniil A., Dacek, Stephen T., Rong, Ziqin, Urban, Alexander, Cao, Shan, Luo, Chuan, Ceder, Gerbrand

Journal:

Physical Review B

Year:

2016

Language:

english

File:

PDF, 604 KB

english, 2016

21

Evaluating structure selection in the hydrothermal growth of FeS2 pyrite and marcasite

Kitchaev, Daniil A., Ceder, Gerbrand

Journal:

Nature Communications

Year:

2016

Language:

english

File:

PDF, 681 KB

english, 2016

22

Mapping skyrmion stability in uniaxial lacunar spinel magnets from first principles

Kitchaev, Daniil A., Schueller, Emily C., Van der Ven, Anton

Journal:

Physical Review B

Year:

2020

File:

PDF, 1.94 MB

2020

23

Rapid Photovoltaic Device Characterization through Bayesian Parameter Estimation

Brandt, Riley E., Kurchin, Rachel C., Steinmann, Vera, Kitchaev, Daniil, Roat, Chris, Levcenco, Sergiu, Ceder, Gerbrand, Unold, Thomas, Buonassisi, Tonio

Journal:

Year:

2017

Language:

english

File:

PDF, 1.53 MB

english, 2017

24

Short-range Order and Unusual Modes of Nickel Redox in a Fluorine-substituted Disordered Rocksalt Oxide Lithium-ion Cathode

Clément, Raphaële J., Kitchaev, Daniil, Lee, Jinhyuk, Ceder, Gerbrand

Journal:

Chemistry of Materials

Year:

2018

Language:

english

File:

PDF, 1.49 MB

english, 2018

25

An efficient algorithm for finding the minimum energy path for cation migration in ionic materials

Rong, Ziqin, Kitchaev, Daniil, Canepa, Pieremanuele, Huang, Wenxuan, Ceder, Gerbrand

Journal:

The Journal of Chemical Physics

Year:

2016

Language:

english

File:

PDF, 3.64 MB

english, 2016

26

High-fraction brookite films from amorphous precursors

Haggerty, James E. S., Schelhas, Laura T., Kitchaev, Daniil A., Mangum, John S., Garten, Lauren M., Sun, Wenhao, Stone, Kevin H., Perkins, John D., Toney, Michael F., Ceder, Gerbrand, Ginley, David S.

Journal:

Scientific Reports

Year:

2017

Language:

english

File:

PDF, 3.61 MB

english, 2017

27

Improved Cycling Performance of Li-Excess Cation-Disordered Cathode Materials upon Fluorine Substitution

Lun, Zhengyan, Ouyang, Bin, Kitchaev, Daniil A., Clément, Raphaële J., Papp, Joseph K., Balasubramanian, Mahalingam, Tian, Yaosen, Lei, Teng, Shi, Tan, McCloskey, Bryan D., Lee, Jinhyuk, Ceder, Gerbra

Journal:

Advanced Energy Materials

Year:

2018

Language:

english

File:

PDF, 2.30 MB

english, 2018

28

polymorphs in density functional theory

Kitchaev, Daniil A., Peng, Haowei, Liu, Yun, Sun, Jianwei, Perdew, John P., Ceder, Gerbrand

Journal:

Physical Review B

Year:

2016

Language:

english

File:

PDF, 890 KB

english, 2016

29

Fluorination of Lithium-Excess Transition Metal Oxide Cathode Materials

Richards, William D., Dacek, Stephen T., Kitchaev, Daniil A., Ceder, Gerbrand

Journal:

Advanced Energy Materials

Year:

2017

Language:

english

File:

PDF, 1.19 MB

english, 2017

30

Modeling the structural distortion and magnetic ground state of the polar lacunar spinel

Schueller, Emily C., Zuo, Julia L., Bocarsly, Joshua D., Kitchaev, Daniil A., Wilson, Stephen D., Seshadri, Ram

Journal:

Physical Review B

Year:

2019

File:

PDF, 1.59 MB

2019

31

The interplay between thermodynamics and kinetics in the solid-state synthesis of layered oxides

Bianchini, Matteo, Wang, Jingyang, ClÃ©ment, RaphaÃ«le J., Ouyang, Bin, Xiao, Penghao, Kitchaev, Daniil, Shi, Tan, Zhang, Yaqian, Wang, Yan, Kim, Haegyeom, Zhang, Mingjian, Bai, Jianming, Wang, Feng,

Journal:

Nature Materials

Year:

2020

File:

PDF, 2.80 MB

2020

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