diff --git a/publications/articles.yaml b/publications/articles.yaml index 0960fb0..106c0e0 100644 --- a/publications/articles.yaml +++ b/publications/articles.yaml @@ -1,3 +1,10 @@ +- authors: Adam M. Krajewski, Allison M. Beese, Wesley F. Reinhart, and Zi-Kui Liu + title: Efficient generation of grids and traversal graphs in compositional spaces towards exploration and path planning + metadata: npj Unconv. Comput. 1, 12 (2024) + arXiv: https://arxiv.org/abs/2402.03528 + DOI: https://doi.org/10.1038/s44335-024-00012-2 + URL: https://nimplex.phaseslab.org + - authors: "Lavanya Raman, Arindam Debnath, Erik Furton, Shuang Lin, Adam Krajewski, Subrata Ghosh, Na Liu, Marcia Ahn, Bed Poudel, Shunli Shang, Shashank Priya, Zi-Kui Liu, Allison M. Beese, Wesley Reinhart, and Wenjie Li" title: "Data-driven inverse design of MoNbTiVWZr refractory multicomponent alloys: Microstructure and mechanical properties" metadata: "Mater. Sci. Eng. A 918 (2024) 147475." @@ -32,90 +39,105 @@ DOI: https://doi.org/10.11900/0412.1961.2024.00147 arXiv: null URL: https://www.ams.org.cn/CN/10.11900/0412.1961.2024.00147 + - authors: "Wei Yu, Xiaoyu Chong, Yingxue Liang, Xingyu Gao, Yan Wei, Shun-Li Shang, Mengdi Gan, Yang Lin, Aimin Zhang, Haijun Wu, Li Chen, Jing Feng, Zi-Kui Liu, and Haifeng Song" title: "Discovering novel γ-γ' Pt-Al superalloys via lattice stability in Pt3Al induced by local atomic environment distortion" metadata: "Acta Mater 281 (2024) 120413." DOI: https://doi.org/10.1016/j.actamat.2024.120413 arXiv: null URL: null + - authors: "Shun-Li Shang, Michael C. Gao, David E. Alman, and Zi-Kui Liu" title: "Effect of hydrogen on surface energy of fcc Fe alloys: A first-principles study" metadata: "Mater. Today Commun. 41 (2024) 110315." DOI: https://doi.org/10.1016/j.mtcomm.2024.110315 arXiv: null URL: null + - authors: "Shun-Li Shang, Shuang Lin, Michael C. Gao, Darrell G. Schlom, and Zi-Kui Liu" title: "Ellingham diagrams of binary oxides" metadata: "APL Mater. 12 (2024) 081110." DOI: https://doi.org/10.1063/5.0216426 arXiv: http://arxiv.org/abs/2308.05837 URL: null + - authors: "Hao-De Dong, Peng Zhang, Ming-Yang Qin, Jian Hui, Hong Wang, Zi-Kui Liu, and X.-D. Xiang" title: "Quantitative understanding of the initial stage of liquid to crystalline or amorphous phase transitions" metadata: "Innov. Mater. 3 (2024) 100086." DOI: https://doi.org/10.59717/j.xinn-mater.2024.100086 arXiv: null URL: null + - authors: "Cole Britt, Stephen Cluff, Zi-Kui Liu, Allison M. Beese, and Jayme Keist" title: "Effect of local variations in thermal history on the microstructures and hardness of a high-strength, low-alloy martensitic steel made by directed energy deposition" metadata: "Mater. Sci. Eng. A 910 (2024) 146890." DOI: https://doi.org/10.1016/j.msea.2024.146890 arXiv: null URL: null + - authors: "Jieru Yu, Jinglian Du, Shun-Li Shang, Hejian Fu, Yang Hao, Liubaixiang He, Zi-Kui Liu, and Feng Liu" title: "Tailoring the stability of iron carbides to enhance the mechanical performances of Fe-C-Mn-Si alloys" metadata: "J. Mater. Sci. 59 (2024) 11157-11176." DOI: https://doi.org/10.1007/s10853-024-09824-w arXiv: null URL: null + - authors: 'Hui Sun, Bo Pan, Zhening Yang, Adam M. Krajewski, Brandon Bocklund, Shun-Li Shang, Jingjing Li, Allison M. Beese, and Zi-Kui Liu' title: 'MaterialsMap: A CALPHAD-based tool to design composition pathways through feasibility map for desired dissimilar materials' metadata: 'Materialia 36 (2024) 102153.' DOI: https://doi.org/10.1016/j.mtla.2024.102153 arXiv: null URL: null + - authors: 'Chang Zhou, Zhiyong Tang, Xiangqi Kong, Yongxiao Zhou, Mingqing Liao, Jingrui Qian, Chenxi Liu, Yuzhu Song, Zi-Kui Liu, Longlong Fan, Naike Shi, and Jun Chen' title: 'High-performance zero thermal expansion in Al metal matrix composites' metadata: 'Acta Materialia 275 (2024) 120076.' DOI: https://doi.org/10.1016/j.actamat.2024.120076 arXiv: null URL: null + - authors: 'Zi-Kui Liu' title: 'Quantitative Predictive Theories through Integrating Quantum, Statistical, Equilibrium, and Nonequilibrium Thermodynamics' metadata: 'J. Phys.: Condens. Matter. 36 (2024) 343003.' DOI: https://doi.org/10.1088/1361-648X/ad4762 arXiv: https://arxiv.org/abs/2402.04143 URL: null + - authors: 'Shun-Li Shang, Rushi Gong, Michael C. Gao, Darren C. Pagan, and Zi-Kui Liu' title: 'Revisiting first-principles thermodynamics by quasiharmonic approach: Application to study thermal expansion of additively-manufactured Inconel 625' metadata: 'Scr. Mater. 250 (2024) 116200.' DOI: https://doi.org/10.1016/j.scriptamat.2024.116200 arXiv: https://arxiv.org/abs/2405.09445 URL: null + - authors: 'Jieun Kim, Muqing Yu, Jung-Woo Lee, Shun-Li Shang, Gi-Yeop Kim, Pratap Pal, Jinsol Seo, Neil Campbell, Kitae Eom, Ranjani Ramachandran, Mark S. Rzchowski, Sang Ho Oh, Si-Young Choi, Zi-Kui Liu, Jeremy Levy, and Chang-Beom Eom' title: 'Electronic-grade epitaxial (111) KTaO3 heterostructures' metadata: 'Sci. Adv. 10 (2024) eadk4288.' DOI: https://doi.org/10.1126/sciadv.adk4288 arXiv: https://arxiv.org/abs/2308.13180 URL: null + - authors: 'Hui Xue, Yi Song, Xinhuan Tong, Yongfeng Liang, Hui Peng, Yanli Wang, Shun-Li Shang, Zi-Kui Liu, and Junpin Lin' title: 'Enhancing strength and ductility in high Nb-containing TiAl alloy additively manufactured via directed energy deposition' metadata: 'Additive Manufacturing 86 (2024) 104194.' DOI: https://doi.org/10.1016/j.addma.2024.104194 arXiv: null URL: null + - authors: 'Kaixin Liang, Yongfeng Liang, Hui Zhang, Feiying Tang, Shun-Li Shang, Zi-Kui Liu, and Junpin Lin' title: 'Boosting oxygen reduction electrocatalytic performance of Cu-Nx by modulating electron structure via construction of Cu-Nx and Cu nanocluster coupling catalyst' metadata: 'Int. J. Hydrogen Ene. 69 (2024) 21-30.' DOI: https://doi.org/10.1016/j.ijhydene.2024.04.362 arXiv: null URL: null + - authors: 'Rushi Gong, Shun-Li Shang, Yi Wang, Jorge Paz Soldan Palma, Hojong Kim, and Zi-Kui Liu' title: 'Revisiting thermodynamics in (LiF, NaF, KF, CrF2)–CrF3 by first-principles calculations and CALPHAD modeling' metadata: 'CALPHAD 85 (2024) 102703.' DOI: https://doi.org/10.1016/j.calphad.2024.102703 arXiv: null URL: null + - authors: 'Mengdi Gan, Xiaoyu Chong, Tianlong Lu, Chao Yang, Wei Yu, Shun-Li Shang, Yi Wang, Zi-Kui Liu, and Jing Feng' title: 'Unveiling thermal stresses in RETaO4 (RE= Nd, Sm, Eu, Gd, Tb, Dy, Ho and Er) by first-principles calculations and finite element simulations' metadata: 'Acta Mater. 271 (2024) 119904.' diff --git a/publications/inpress.yaml b/publications/inpress.yaml index 9ff2e23..4077d54 100644 --- a/publications/inpress.yaml +++ b/publications/inpress.yaml @@ -5,13 +5,6 @@ DOI: null URL: null -- authors: "Adam M. Krajewski, Allison M. Beese, Wesley F. Reinhart, and Zi-Kui Liu" - title: "Efficient Generation of Grids and Traversal Graphs in Compositional Spaces towards Exploration and Path Planning Exemplified in Materials" - metadata: "Accepted at the npj Unconventional Computing" - arXiv: https://arxiv.org/abs/2402.03528 - DOI: https://doi.org/10.1038/s44335-024-00012-2 - URL: https://nimplex.phaseslab.org - - authors: "Adam M. Krajewski, Arindam Debnath, Allison M. Beese, Wesley F. Reinhart, and Zi-Kui Liu" title: "nimCSO: A Nim package for Compositional Space Optimization" metadata: "Accepted at the Journal of Open Source Software (JOSS)"