Results 121 to 130 of about 403 (217)
The Importance of Metal‐Organic Framework Linker Atoms for CO2 Reduction: A DFT Study
Advanced Science, EarlyView.Using DFT, we examine the role of linker atoms in CO2 reduction on copper‐based metal organic frameworks (Cu MOFs). Our calculations reveal that linker atoms may serve as both CO2 and H‐shuttling sites and suggest linker electrostatics as a descriptor for linker activity. ABSTRACT
Although the metal within the secondary building unit of a metal‐organic Ugochukwu Nwosu, Samira Siahrostamiwiley +1 more sourceMultiple outflows and delayed ejections revealed by early imaging of novae. [PDF]
Nat AstronAydi E, Monnier JD, Mérand A, Schaefer GH, Chomiuk L, Otulakowska-Hypka M, Fan JL, Li KL, Sokolovsky KV, Salinas R, Tucker M, Shappee B, Rudy R, Page KL, Kuin NPM, Buckley DAH, Craig P, Izzo L, Linford J, Metzger BD, Mukai K, Orio M, Shen KJ, Strader J, Sokoloski JL, Williams RE, Williams MN, Habtie GR, Kraus S, Anugu N, Bouquin JL, Chhabra S, Codron I, Gardner T, Gutierrez M, Ibrahim N, Lanthermann C, Setterholm BR, Ashall C, Hinkle JT, Jaeger T, Payne AV. +41 moreeuropepmc +1 more sourceTunable Negative Thermal Expansion in Fe/Cr‐Substituted Nd2Co17 Compounds via Magnetoelastic Coupling
Advanced Science, EarlyView.This study achieves anisotropic thermal expansion tuning in Nd2(Co1‐xFex)17‐yCry compounds via a magnetoelastic strategy. Variable‐temperature synchrotron X‐ray diffraction reveals that increased Fe content induces switchable lattice responses. Compositional control reduces the volume expansion coefficient αV by 20% (x═0.7) and modulates TC (442–625 K),Jiayuan Li, Chenfei Qv, Haoran Tu, Qinfen Gu, Wayne D. Hutchison, Stewart J. Campbell, Zhenxiang Cheng, Wenquan Wang, Jianli Wang +8 morewiley +1 more source<i>pyDiSCaMB</i>: enabling the use of multipolar scattering factors in <i>Phenix</i>. [PDF]
J Appl CrystallogrFemoen VJ, Pacoste L, Chodkiewicz ML, Afonine PV, Poon BK, Kulik M, Golon Ł, Moriarty NW, Adams PD, Hofer G, Dominiak PM, Liebschner D, Zou X. +12 moreeuropepmc +1 more sourceUnifying Composition and Process Design: A Heterogeneous Graph Neural Network for Discovering High‐Performance Cu Alloys
Advanced Science, EarlyView.By overcoming the fixed‐path limitations of conventional machine learning, a heterogeneous graph neural network fundamentally reconstructs material data representation. Integrating variable processing sequences with intrinsic elemental features, this framework enables exploratory optimization across high‐dimensional spaces.Jie Yin, Qian Lei, Wei Yan, Yue Li, Tong Xie, Shuang Zhou, Chong Wang, Bram Hoex, Qiang Long, Caoyang Jiang, Min Song, Zhou Li, Zhangwei Wang +12 morewiley +1 more sourceUltrahigh-energy gamma-ray emission associated with black hole-jet systems. [PDF]
Natl Sci RevCao Z, Aharonian F, Bai YX, Bao YW, Bastieri D, Bi XJ, Bi YJ, Bian WY, Bukevich AV, Cai C, Cao WY, Cao Z, Chang J, Chang JF, Chen A, Chen ES, Chen G, Chen HX, Chen L, Chen L, Chen MJ, Chen ML, Chen QH, Chen S, Chen SH, Chen SZ, Chen TL, Chen XB, Chen X, Chen Y, Cheng N, Cheng YD, Chu MC, Cui MY, Cui SW, Cui XH, Cui YD, Dai BZ, Dai HL, Dai Z, Luobu D, Diao YX, Dong XQ, Duan KK, Fan JH, Fan YZ, Fang J, Fang JH, Fang K, Feng CF, Feng H, Feng L, Feng S, Feng XT, Feng Y, Feng YL, Gabici S, Gao B, Gao CD, Gao Q, Gao W, Gao WK, Ge M, Ge TT, Geng L, Giacinti G, Gong G, Gou Q, Gu MH, Guo FL, Guo J, Guo XL, Guo YQ, Guo YY, Han YA, Hannuksela OA, Hasan M, He HH, He HN, He JY, He X, He Y, Hernández-Cadena S, Hou BW, Hou C, Hou X, Hu HB, Hu SC, Huang C, Huang DH, Huang J, Huang TQ, Huang WJ, Huang XT, Huang XY, Huang Y, Huang YY, Ji XL, Jia HY, Jia K, Jiang HB, Jiang K, Jiang XW, Jiang ZJ, Jin M, Kaci S, Kang MM, Karpikov I, Khangulyan D, Kuleshov D, Kurinov K, Li BB, Li C, Li C, Li D, Li F, Li H, Li H, Li J, Li J, Li K, Li L, Li RL, Li SD, Li TY, Li WL, Li XR, Li X, Li Y, Li Y, Li Z, Li Z, Liang EW, Liang YF, Lin SJ, Liu B, Liu C, Liu D, Liu DB, Liu H, Liu HD, Liu J, Liu JL, Liu JR, Liu MY, Liu RY, Liu SM, Liu W, Liu X, Liu Y, Liu Y, Liu YN, Lou YQ, Luo Q, Luo Y, Lv HK, Ma BQ, Ma LL, Ma XH, Mao JR, Min Z, Mitthumsiri W, Mou GB, Mu HJ, Neronov A, Ng KCY, Ni MY, Nie L, Ou LJ, Pattarakijwanich P, Pei ZY, Qi JC, Qi MY, Qin JJ, Raza A, Ren CY, Ruffolo D, Sáiz A, Semikoz D, Shao L, Shchegolev O, Shen YZ, Sheng XD, Shi Z, Shu FW, Song HC, Stenkin YV, Stepanov V, Su Y, Sun D, Sun H, Sun Q, Sun X, Sun Z, Tabasam NH, Takata J, Tam PHT, Tan HB, Tang Q, Tang R, Tang Z, Tian W, Tong C, Wan LH, Wang C, Wang G, Wang H, Wang J, Wang K, Wang K, Wang L, Wang L, Wang LY, Wang R, Wang W, Wang X, Wang XJ, Wang XY, Wang Y, Wang YD, Wang ZH, Wang ZX, Wang Z, Wei DM, Wei JJ, Wei YJ, Wen T, Weng SS, Wu CY, Wu HR, Wu QW, Wu S, Wu XF, Wu YS, Xi SQ, Xia J, Xia JJ, Xiang GM, Xiao DX, Xiao G, Xin YL, Xing Y, Xiong DR, Xiong Z, Xu DL, Xu RF, Xu RX, Xu WL, Xue L, Yan DH, Yan JZ, Yan T, Yang CW, Yang CY, Yang FF, Yang LL, Yang MJ, Yang RZ, Yang WX, Yang Z, Yao ZG, Ye XA, Yin LQ, Yin N, You XH, You ZY, Yu YH, Yuan Q, Yue H, Zeng HD, Zeng TX, Zeng W, Zeng X, Zha M, Zhang BB, Zhang BT, Zhang C, Zhang F, Zhang HF, Zhang HM, Zhang HY, Zhang JL, Zhang L, Zhang PF, Zhang PP, Zhang R, Zhang SR, Zhang SS, Zhang W, Zhang X, Zhang XP, Zhang Y, Zhang Y, Zhang ZP, Zhao J, Zhao L, Zhao LZ, Zhao SP, Zhao XH, Zhao Z, Zheng F, Zhong WJ, Zhou B, Zhou H, Zhou JN, Zhou M, Zhou P, Zhou R, Zhou XX, Zhou XX, Zhu BY, Zhu CG, Zhu FR, Zhu H, Zhu KJ, Zou YC, Zuo X. +316 moreeuropepmc +1 more sourceAtacama Large Aperture Submillimeter Telescope (AtLAST) science: Probing the transient and time-variable sky. [PDF]
Open Res EurOrlowski-Scherer J, Maccarone T, Bright J, Kamiński T, Koss M, Mohan A, Miguel Montenegro-Montes F, Næss S, Ricci C, Severgnini P, Stanke T, Vignali C, Wedemeyer S, Booth M, Cicone C, Di Mascolo L, Johnstone D, Mroczkowski T, Cordiner M, Greiner J, Hatziminaoglou E, van Kampen E, Klaassen P, Lee M, Liu D, Saintonge A, Smith M, Thelen A. +27 moreeuropepmc +1 more sourceHarnessing Phase Separation for the Development of High‐Performance Hydrogels
Advanced Science, EarlyView.ABSTRACT
Hydrogels are indispensable for the development of next‐generation bioelectronics, soft robotics, and biomedical devices, where their mechanical properties determine performance and reliability. Among strategies to enhance hydrogel mechanics, phase separation enables controlled heterogeneity resulting in gel networks that are reinforced by ...Yue Shao, Yiming Ma, Baihao Shao, Molly M. Stevens +3 morewiley +1 more source
