From ultrasoft pseudopotentials to the projector augmented-wave method

Kresse, G., Joubert, D.·1999·Physical Review B

Cited by (1,098)

Items 801–900 of 1,098

  1. Influence of strain and oxygen vacancies on the magnetoelectric properties of multiferroic bismuth ferrite
    Claude Ederer, Nicola A. Spaldin · 2005 · Physical Review B
  2. Magnetically-driven phase transformation strengthening in high entropy alloys
    Changning Niu, Carlyn R. LaRosa, Jiashi Miao, Michael J. Mills, Maryam Ghazisaeidi · 2018 · Nature Communications
  3. Interfacial Electron Transfer of Ni 2 P–NiP 2 Polymorphs Inducing Enhanced Electrochemical Properties
    Tong Liu, Anran Li, Chengbo Wang, Wei Zhou, Shijie Liu, Lin Guo · 2018 · Advanced Materials
  4. Strong Electronic Oxide–Support Interaction over In 2 O 3 /ZrO 2 for Highly Selective CO 2 Hydrogenation to Methanol
    Chengsheng Yang, Chunlei Pei, Ran Luo · 2020 · Journal of the American Chemical Society
  5. Simultaneously enhancing the ultimate strength and ductility of high-entropy alloys via short-range ordering
    Shuai Chen, Zachary H. Aitken, Subrahmanyam Pattamatta, Zhaoxuan Wu, Zhi Gen Yu, David J. Srolovitz, Peter Kaehuei Liaw, Yong‐Wei Zhang · 2021 · Nature Communications
  6. Band Gap Narrowing of Titanium Oxide Semiconductors by Noncompensated Anion-Cation Codoping for Enhanced Visible-Light Photoactivity
    Wenguang Zhu, Xiaofeng Qiu, Violeta Iancu, Xing‐Qiu Chen, Hui Pan, Wei Wang, Nada M. Dimitrijević, Tijana Rajh, Harry M. Meyer, Mariappan Parans Paranthaman et al. · 2009 · Physical Review Letters
  7. Boosting hydrogen evolution on MoS2 via co-confining selenium in surface and cobalt in inner layer
    Zhilong Zheng, Liang Yu, Meng Gao, Xiya Chen, Wu Zhou, Chao Ma, Li-Hui Wu, Jun-Fa Zhu, Xiang-Yu Meng, Jingting Hu et al. · 2020 · Nature Communications
  8. Unified mechanistic understanding of CO2 reduction to CO on transition metal and single atom catalysts
    Sudarshan Vijay, Wen Ju, Sven Brückner, Sze‐Chun Tsang, Peter Strasser, Karen Chan · 2021 · Nature Catalysis
  9. Electronic structure, mechanical properties and thermal conductivity of Ln2Zr2O7 (Ln=La, Pr, Nd, Sm, Eu and Gd) pyrochlore
    Jing Feng, Bing Xiao, C.L. Wan · 2010 · Acta Materialia
  10. One-dimensional van der Waals heterostructures
    Rong Xiang, Taiki Inoue, Yongjia Zheng, Akihito Kumamoto, Qian Yang, Yuta Sato, Ming Liu, Daiming Tang, Devashish Gokhale, Jia Guo et al. · 2020 · Science
  11. Constraining CO coverage on copper promotes high-efficiency ethylene electroproduction
    Jun Li, Ziyun Wang, Christopher McCallum, Yi Xu, Fengwang Li, Yuhang Wang, Christine M. Gabardo, Cao‐Thang Dinh, Tao‐Tao Zhuang, Liang Wang et al. · 2019 · Nature Catalysis
  12. In situ X-ray diffraction monitoring of a mechanochemical reaction reveals a unique topology metal-organic framework
    Athanassios D. Katsenis, Andreas Puškarić, Vjekoslav Štrukil, Cristina Mottillo, Patrick Julien, Krunoslav Užarević, Minh-Hao Pham, Trong‐On Do, Simon A. J. Kimber, Predrag Lazić et al. · 2015 · Nature Communications
  13. Propelling polysulfides transformation for high-rate and long-life lithium–sulfur batteries
    Cheng Zheng, Shuzhang Niu, Wei Zhong Lv, Guangmin Zhou, Jia Zhao Li, Shaoxun Fan, Yaqian Deng, Zheng‐Ze Pan, Baohua Li, Feiyu Kang et al. · 2017 · Nano Energy
  14. Mechanism of Sodium Storage in Hard Carbon: An X‐Ray Scattering Analysis
    Yusuke Morikawa, Shin‐ichi Nishimura, Ryuichi Hashimoto, Masato Ohnuma, Atsuo Yamada · 2019 · Advanced Energy Materials
  15. Tunable Photocatalytic Water Splitting by the Ferroelectric Switch in a 2D AgBiP 2 Se 6 Monolayer
    Lin Ju, Jing Shang, Xiao Xia Tang, Liangzhi Kou · 2019 · Journal of the American Chemical Society
  16. Crystal Orbital Bond Index: Covalent Bond Orders in Solids
    Peter C. Müller, Christina Ertural, Jan Hempelmann · 2021 · The Journal of Physical Chemistry C
  17. Sources of Electrical Conductivity in SnO 2
    Abhishek Kumar Singh, Anderson Janotti, Matthias Scheffler, Chris G. Van de Walle · 2008 · Physical Review Letters
  18. Efficient generation of generalized Monkhorst-Pack grids through the use of informatics
    Pandu Wisesa, Kyle A. McGill, Tim Mueller · 2016 · Physical review. B./Physical review. B
  19. High-Performance Rh 2 P Electrocatalyst for Efficient Water Splitting
    Haohong Duan, Dongguo Li, Yan Tang, Yang He, Shufang Ji, Rongyue Wang, Haifeng Lv, Pietro Papa Lopes, Arvydas Paul Paulikas, Haoyi Li et al. · 2017 · Journal of the American Chemical Society
  20. Tkatchenko-Scheffler van der Waals correction method with and without self-consistent screening applied to solids
    Tomáš Bučko, Sébastien Lebègue∥, J. Häfner · 2013 · Physical Review B
  21. Density functional study of CO on Rh(111)
    Lukas Köhler, Georg Kresse · 2004 · Physical Review B
  22. Theoretical prediction of MoN 2 monolayer as a high capacity electrode material for metal ion batteries
    Xiaoming Zhang, Zhiming Yu, Shan-Shan Wang, Shan Guan, Hui Ying Yang, Yugui Yao, Shengyuan A. Yang · 2016 · Journal of Materials Chemistry A
  23. Discovery of TaFeSb-based half-Heuslers with high thermoelectric performance
    Hangtian Zhu, Jun Mao, Yuwei Li, Jifeng Sun, Yumei Wang, Qing Zhu, Guannan Li, Qichen Song, Jiawei Zhou, Yuhao Fu et al. · 2019 · Nature Communications
  24. An Ultrafast Conducting Polymer@MXene Positive Electrode with High Volumetric Capacitance for Advanced Asymmetric Supercapacitors
    Ke Li, Xuehang Wang, Shuo Li · 2019 · Small
  25. Graphene-like titanium carbides and nitrides Tin+1Cn, Tin+1Nn (n=1, 2, and 3) from de-intercalated MAX phases: First-principles probing of their structural, electronic properties and relative stability
    Igor R. Shein, A. L. Ivanovskiĭ · 2012 · Computational Materials Science
  26. Anisotropic in-plane thermal conductivity of black phosphorus nanoribbons at temperatures higher than 100 K
    Sangwook Lee, Fan Yang, Joonki Suh, Sijie Yang, Yeonbae Lee, Li Guo, Hwan Sung Choe, Aslıhan Süslü, Yabin Chen, Changhyun Ko et al. · 2015 · Nature Communications
  27. Pressure-stabilized superconductive yttrium hydrides
    Yinwei Li, Jian Hao, Hanyu Liu · 2015 · Scientific Reports
  28. Quantum chemical accuracy from density functional approximations via machine learning
    Mihail Bogojeski, Leslie Vogt-Maranto, Mark E. Tuckerman, Klaus‐Robert Müller, Kieron Burke · 2020 · Nature Communications
  29. Scalable enhancement of graphene oxide properties by thermally driven phase transformation
    Priyank V. Kumar, Neelkanth Manoj Bardhan, Sefaattin Tongay, Junqiao Wu, Angela M. Belcher, Jeffrey C. Grossman · 2013 · Nature Chemistry
  30. Cupric Phosphate Nanosheets-Wrapped Inorganic Membranes with Superhydrophilic and Outstanding Anticrude Oil-Fouling Property for Oil/Water Separation
    Shenxiang Zhang, Gaoshuo Jiang, Shoujian Gao · 2018 · ACS Nano
  31. A General Atomic Surface Modification Strategy for Improving Anchoring and Electrocatalysis Behavior of Ti 3 C 2 T 2 MXene in Lithium–Sulfur Batteries
    Dashuai Wang, Fei Li, Ruqian Lian, Jing Xu, Dongxiao Kan, Yanhui Liu, Gang Chen, Yury G. Gogotsi, Yingjin Wei · 2019 · ACS Nano
  32. Consequences of Optimal Bond Valence on Structural Rigidity and Improved Luminescence Properties in SrxBa2–xSiO4:Eu2+ Orthosilicate Phosphors
    Kristin A. Denault, Jakoah Brgoch, Michael W. Gaultois, Alexander A. Mikhailovsky, Ralf Petry, Holger Winkler, Steven P. DenBaars, Ram Seshadri · 2014 · Chemistry of Materials
  33. Linear Alkane Polymerization on a Gold Surface
    Dingyong Zhong, Joern-Holger Franke, Santhosh Kumar Podiyanachari, Tobias Blömker, Haiming Zhang, Gerald Kehr, Gerhard Erker, Harald Fuchs, Lifeng Chi · 2011 · Science
  34. An atomic-scale view of single-site Pt catalysis for low-temperature CO oxidation
    Andrew J. Therrien, Alyssa J. R. Hensley, Matthew D. Marcinkowski, Renqin Zhang, Felicia R. Lucci, Benjamin P. Coughlin, Alex C. Schilling, Jean‐Sabin McEwen, E. Charles H. Sykes · 2018 · Nature Catalysis
  35. Room temperature in-plane ferroelectricity in van der Waals In 2 Se 3
    Changxi Zheng, Lei Yu, Lin Zhu, James L. Collins, Dohyung Kim, Yaoding Lou, Chao Xu, Meng Li, Zheng Wei, Yupeng Zhang et al. · 2018 · Science Advances
  36. Topological chiral crystals with helicoid-arc quantum states
    Daniel S. Sanchez, Ilya Belopolski, Tyler A. Cochran, Xitong Xu, Jia‐Xin Yin, Guoqing Chang, Weiwei Xie, Kaustuv Manna, Vicky Süß, Cheng-Yi Huang et al. · 2019 · Nature
  37. Ultra-fast NH4+ Storage: Strong H Bonding between NH4+ and Bi-layered V2O5
    Shengyang Dong, Woochul Shin, Heng Jiang, Xianyong Wu, Zhifei Li, John J. Holoubek, William F. Stickle, Baris Key, Cong Liu, Jun Biao Lu et al. · 2019 · Chem
  38. Synergizing metal–support interactions and spatial confinement boosts dynamics of atomic nickel for hydrogenations
    Jian Gu, Minzhen Jian, Li Huang et al. · 2021 · Nature Nanotechnology
  39. Electronic correlation effects in transition-metal sulfides
    A Rohrbach, J. Häfner, Georg Kresse · 2003 · Journal of Physics Condensed Matter
  40. Manipulating dehydrogenation kinetics through dual-doping Co3N electrode enables highly efficient hydrazine oxidation assisting self-powered H2 production
    Liu, Yi, Zhang, Jihua, Li, Yapeng, Qian, Qizhu, Li, Ziyun, Zhu, Yin, Zhang, Genqiang · 2020 · Nature Communications
  41. Interface engineering breaks both stability and activity limits of RuO2 for sustainable water oxidation
    Kun Du, Lifu Zhang, Jieqiong Shan, Jiaxin Guo, Jing Mao, Chueh‐Cheng Yang, Chia‐Hsin Wang, Zhenpeng Hu, Tao Ling · 2022 · Nature Communications
  42. Cohesive Properties and Asymptotics of the Dispersion Interaction in Graphite by the Random Phase Approximation
    Sébastien Lebègue∥, Judith Harl, Tim Gould · 2010 · Physical Review Letters
  43. Calcium-Decorated Graphene-Based Nanostructures for Hydrogen Storage
    Hoonkyung Lee, Jisoon Ihm, Marvin L. Cohen · 2010 · Nano Letters
  44. First-Principles Calculations and CALPHAD Modeling of Thermodynamics
    Zi‐Kui Liu · 2009 · Journal of Phase Equilibria and Diffusion
  45. Graphene adhesion on MoS2 monolayer: An ab initio study
    Yandong Ma, Ying Dai, Meng Guo, Chengwang Niu, Baibiao Huang · 2011 · Nanoscale
  46. Activation of Cu(111) surface by decomposition into nanoclusters driven by CO adsorption
    Baran Eren, Danylo Zherebetskyy, Laerte L. Patera, Chenghao Wu, Hendrik Bluhm, Cristina Africh, Lin‐Wang Wang, Gábor A. Somorjai, Miquel Salmerón · 2016 · Science
  47. Facet Engineered α-MnO 2 for Efficient Catalytic Ozonation of Odor CH 3 SH: Oxygen Vacancy-Induced Active Centers and Catalytic Mechanism
    Chun He, Yunchen Wang, Zhiyao Li, Yajing Huang, Yuhong Liao, Dehua Xia, Shuncheng Lee · 2020 · Environmental Science & Technology
  48. First-principles design of a single-atom–alloy propane dehydrogenation catalyst
    Ryan Travis Hannagan, Georgios Giannakakis, Romain Réocreux, Julia Schumann, Jordan Finzel, Yicheng Wang, Angelos Michaelides, Prashant Deshlahra, Phillip Christopher, Maria Flytzani‐Stephanopoulos et al. · 2021 · Science
  49. Flatbands and Emergent Ferromagnetic Ordering in Fe 3 Sn 2 Kagome Lattices
    Zhiyong Lin, Jin‐Ho Choi, Qiang Zhang, Wei Qin, Seho Yi, Pengdong Wang, Lin Li, Yifan Wang, Hui Zhang, Zhe Sun et al. · 2018 · Physical Review Letters
  50. Novel 2D Transition‐Metal Carbides: Ultrahigh Performance Electrocatalysts for Overall Water Splitting and Oxygen Reduction
    Yadong Yu, Jian Zhou, Zhimei Sun · 2020 · Advanced Functional Materials
  51. Tuning LDA+U for electron localization and structure at oxygen vacancies in ceria
    C. W. M. Castleton, Jolla Kullgren, Kersti Hermansson · 2007 · The Journal of Chemical Physics
  52. Inverse Design of High Absorption Thin‐Film Photovoltaic Materials
    Liping Yu, Robert S. Kokenyesi, Douglas A. Keszler, Alex Zunger · 2012 · Advanced Energy Materials
  53. Ferromagnetic single-atom spin catalyst for boosting water splitting
    Tao Sun, Zhiyuan Tang, Wenjie Zang, Zejun Li, Jing Li, Zhi-Hao Li, Liang Cao, Jan Sebastian Dominic Rodriguez, Carl Osby M. Mariano, Haomin Xu et al. · 2023 · Nature Nanotechnology
  54. Time-Reversal-Breaking Weyl Fermions in Magnetic Heusler Alloys
    Wang, Zhijun, Vergniory, M. G., Kushwaha, S., Hirschberger, Max, Chulkov, E. V., Ernst, A., Ong, N. P., Cava, Robert J., Bernevig, B. Andrei · 2016 · Physical Review Letters
  55. Fully exposed palladium cluster catalysts enable hydrogen production from nitrogen heterocycles
    Chunyang Dong, Zirui Gao, Yinlong Li, Mi Peng, Meng Wang, Yao Xu, Chengyu Li, Ming Hou Xu, Yuchen Deng, Xuetao Qin et al. · 2022 · Nature Catalysis
  56. Computational discovery of single-layer III-V materials
    Houlong L. Zhuang, Arunima K. Singh, Richard G. Hennig · 2013 · Physical Review B
  57. Structure sensitive photocatalytic reduction of nitroarenes over TiO 2
    Swapna Challagulla, Kartick Tarafder, Ramakrishnan Ganesan · 2017 · Scientific Reports
  58. Optical band-gap determination of nanostructured WO3 film
    Pedro Pablo González‐Borrero, Francielle Sato, Antonio Neto Medina · 2010 · Applied Physics Letters
  59. Lithium Peroxide Surfaces Are Metallic, While Lithium Oxide Surfaces Are Not
    Maxwell D. Radin, Jill F. Rodriguez, Feng Tian, Donald J. Siegel · 2011 · Journal of the American Chemical Society
  60. Twisted Bilayer Graphene: A Phonon-Driven Superconductor
    Biao Lian, Zhijun Wang, Bogdan Andrei Bernevig · 2019 · Physical Review Letters
  61. Anomalous thickness dependence of Curie temperature in air-stable two-dimensional ferromagnetic 1T-CrTe2 grown by chemical vapor deposition
    Lingjia Meng, Zhang Zhou, Mingquan Xu, Shiqi Yang, Kunpeng Si, Lixuan Liu, Xingguo Wang, Huaning Jiang, Bixuan Li, Peixin Qin et al. · 2021 · Nature Communications
  62. Wafer-scale heterostructured piezoelectric bio-organic thin films
    Fan Yang, Jun Li, Yin Long, Ziyi Zhang, Linfeng Wang, Jiajie Sui, Yutao Dong, Yizhan Wang, Rachel Taylor, Dalong Ni et al. · 2021 · Science
  63. Angstrom-confined catalytic water purification within Co-TiOx laminar membrane nanochannels
    Chenchen Meng, Baofu Ding, Shaoze Zhang, Lele Cui, Kostya Ostrikov, Ziyang Huang, Bo Yang, Jae‐Hong Kim, Zhenghua Zhang · 2022 · Nature Communications
  64. Electron delocalization triggers nonradical Fenton-like catalysis over spinel oxides
    Zhiyan Guo, Yang Si, Wen-Qi Xia, Fan Wang, Houqi Liu, Cheng Yue Yang, Wenjun Zhang, Wen‐Wei Li · 2022 · Proceedings of the National Academy of Sciences
  65. Generation and electric control of spin–valley-coupled circular photogalvanic current in WSe2
    Yuan, Hongtao, Wang, Xinqiang, Lian, Biao, Zhang, Haijun, Fang, Xianfa, Shen, Bo, Xu, Gang, Xu, Yong, Zhang, Shou-Cheng, Hwang, Harold Y. et al. · 2014 · Nature Nanotechnology
  66. Observation of Topological Nodal Fermion Semimetal Phase in ZrSiS
    Neupane, Madhab, Belopolski, Ilya, Hosen, M. Mofazzel, Sanchez, Daniel S., Sankar, Raman, Szlawska, Maria, Xu, Su-Yang, Dimitri, Klauss, Dhakal, Nagendra, Maldonado, Pablo et al. · 2016 · Physical Review B
  67. Problems with reconciling density functional theory calculations with experiment in ferropnictides
    I. I. Mazin, M. D. Johannes, Lilia Boeri · 2008 · Physical Review B
  68. Shape and Edge Sites Modifications of MoS2 Catalytic Nanoparticles Induced by Working Conditions: A Theoretical Study
    Hannes Schweiger, Pascal Raybaud, Georg Kresse · 2002 · Journal of Catalysis
  69. Density functional theory analysis of the structural and electronic properties of TiO2 rutile and anatase polytypes: Performances of different exchange-correlation functionals
    Frédèric Labat, Philippe Baranek, Christophe Domain, Christian Minot, Carlo Adamo · 2007 · The Journal of Chemical Physics
  70. Cohesive energy curves for noble gas solids calculated by adiabatic connection fluctuation-dissipation theory
    Judith Harl, Georg Kresse · 2008 · Physical Review B
  71. MoS 2 /MX 2 heterobilayers: bandgap engineering via tensile strain or external electrical field
    Ning Lü, Hongyan Guo, Lei Li · 2013 · Nanoscale
  72. Control of zeolite pore interior for chemoselective alkyne/olefin separations
    Yuchao Chai, Xue Han, Weiyao Li, Shanshan Liu, Sikai Yao, Chong Wang, Wei Shi, Iván da Silva, Pascal Manuel, Yongqiang Q. Cheng et al. · 2020 · Science
  73. Bright Blue and Green Luminescence of Sb(III) in Double Perovskite Cs2MInCl6 (M = Na, K) Matrices
    Agnieszka Noculak, Viktoriia Morad, Kyle M. McCall · 2020 · Chemistry of Materials
  74. Self‐Standing CoP Nanosheets Array: A Three‐Dimensional Bifunctional Catalyst Electrode for Overall Water Splitting in both Neutral and Alkaline Media
    Liu, Tingting, Xie, Lisi, Yang, Jianhui, Kong, Rongmei, Du, Gu, Asiri, Abdullah M., Sun, Xuping, Chen, Liang · 2017 · ChemElectroChem
  75. Competing stabilization mechanism for the polar ZnO(0001)-Zn surface
    Georg Kresse, Olga Dulub, Ulrike Diebold · 2003 · Physical review. B, Condensed matter
  76. Importance of Correlation in Determining Electrocatalytic Oxygen Evolution Activity on Cobalt Oxides
    Mónica García‐Mota, Michal Bajdich, Venkatasubramanian Viswanathan, Aleksandra Vojvodić, Alexis T. Bell, Jens K. Nørskov · 2012 · The Journal of Physical Chemistry C
  77. Enhancing Sodium Ion Battery Performance by Strongly Binding Nanostructured Sb2S3 on Sulfur-Doped Graphene Sheets
    Xunhui Xiong, Guanhua Wang, Yu‐Wei Lin, Ying Wang, Xing Ou, Fenghua Zheng, Chenghao Yang, Jeng‐Han Wang, Meilin Liu · 2016 · ACS Nano
  78. Modified embedded atom method potential for Al, Si, Mg, Cu, and Fe alloys
    Bohumir Jelinek, Sébastien Groh, M.F. Horstemeyer, Jeff Houze, Seong‐Gon Kim, Gregory J. Wagner, Amitava Moitra, Michael I. Baskes · 2012 · Physical Review B
  79. Grain Boundary Decohesion by Impurity Segregation in a Nickel-Sulfur System
    Masatake Yamaguchi, Motoyuki Shiga, Hideo Kaburaki · 2005 · Science
  80. Engineering Solar Cell Absorbers by Exploring the Band Alignment and Defect Disparity: The Case of Cu‐ and Ag‐Based Kesterite Compounds
    Zhen‐Kun Yuan, Shiyou Chen, Hongjun Xiang · 2015 · Advanced Functional Materials
  81. Influence of Surface Adsorption on the Oxygen Evolution Reaction on IrO2(110)
    Ding-Yuan Kuo, Jason Ken Kawasaki, Jocienne N. Nelson, Jan Kloppenburg, Geoffroy Hautier, Kyle Shen, Darrell G. Schlom, Jin Suntivich · 2017 · Journal of the American Chemical Society
  82. Low temperature synthesis of ternary metal phosphides using plasma for asymmetric supercapacitors
    Liang, Hanfeng, Xia, Chuan, Jiang, Qiu, Gandi, Appala N., Schwingenschlögl, Udo, Alshareef, Husam N. · 2017 · Nano Energy
  83. Toward Computational Materials Design: The Impact of Density Functional Theory on Materials Research
    J. Häfner, Christopher Wolverton, Gerbrand Ceder · 2006 · MRS Bulletin
  84. Direct insights into the role of epoxy groups on cobalt sites for acidic H2O2 production
    Qingran Zhang, Xin Tan, Nicholas M. Bedford, Zhaojun Han, Lars Thomsen, Sean Campbell Smith, Rose Amal, Xunyu Lu · 2020 · Nature Communications
  85. High-Throughput Screening of Synergistic Transition Metal Dual-Atom Catalysts for Efficient Nitrogen Fixation
    Xingshuai Lv, Wei Wei, Baibiao Huang · 2021 · Nano Letters
  86. Magnetic and Electric Phase Control in Epitaxial EuTiO3 from First Principles
    Craig J. Fennie, Karin M. Rabe · 2006 · Physical Review Letters
  87. Topologically guided tuning of Zr-MOF pore structures for highly selective separation of C6 alkane isomers
    Hao Wang, Xinglong Dong, Junzhong Lin, Simon J. Teat, Stephanie J. Jensen, Jérémy Cure, Eugeny V. Alexandrov, Qibin Xia, Kui Tan, Qining Wang et al. · 2018 · Nature Communications
  88. CO2 hydrogenation on Pt, Pt/SiO2 and Pt/TiO2: Importance of synergy between Pt and oxide support
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  89. Interstitial Occupancy by Extrinsic Alkali Cations in Perovskites and Its Impact on Ion Migration
    Jie Cao, Shuxia Tao, P. A. Bobbert · 2018 · Advanced Materials
  90. Two-Dimensional MoS 2 Confined Co(OH) 2 Electrocatalysts for Hydrogen Evolution in Alkaline Electrolytes
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  91. Transition Metal‐Promoted V2CO2 (MXenes): A New and Highly Active Catalyst for Hydrogen Evolution Reaction
    Chongyi Ling, Li Shi, Yixin Ouyang, Qian Chen, Jinlan Wang · 2016 · Advanced Science
  92. Promoting nickel oxidation state transitions in single-layer NiFeB hydroxide nanosheets for efficient oxygen evolution
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  93. DFT Study of CO 2 Adsorption and Hydrogenation on the In 2 O 3 Surface
    Jingyun Ye, Changjun Liu, Qingfeng Ge · 2012 · The Journal of Physical Chemistry C
  94. Oxygen vacancy formation and migration in ceria
    Michael Nolan, Joanne Fearon, Graeme W. Watson · 2006 · Solid State Ionics
  95. W‐Based Atomic Laminates and Their 2D Derivative W 1.33 C MXene with Vacancy Ordering
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  96. Self-diffusion barriers: possible descriptors for dendrite growth in batteries?
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  97. Metal–polymer hybrid nanomaterials for plasmonic ultrafast hydrogen detection
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  98. Coupling the valley degree of freedom to antiferromagnetic order
    Xiao Li, Ting Cao, Qian Niu, Junren Shi, Ji Feng · 2013 · Proceedings of the National Academy of Sciences
  99. A Simple Molecular Design Strategy for Two-Dimensional Covalent Organic Framework Capable of Visible-Light-Driven Water Splitting
    Yangyang Wan, Lei Wang, Hangxun Xu, Xiaojun Wu, Jinlong Yang · 2020 · Journal of the American Chemical Society
  100. A single-Pt-atom-on-Ru-nanoparticle electrocatalyst for CO-resilient methanol oxidation
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