Gao H, He D, Chen Z, Gao P, He D, Li Z
Sci Adv. 2025; 11(2):eads4038.
PMID: 39772692
PMC: 11708898.
DOI: 10.1126/sciadv.ads4038.
Han S, Ryu B, Jeong I, Lim S, Choi E
Heliyon. 2024; 10(14):e34984.
PMID: 39149056
PMC: 11325366.
DOI: 10.1016/j.heliyon.2024.e34984.
Legein C, Morgan B, Squires A, Body M, Li W, Burbano M
J Am Chem Soc. 2024; 146(31):21889-21902.
PMID: 39056215
PMC: 11311215.
DOI: 10.1021/jacs.4c06304.
Kretschmer A, Mayrhofer P
Sci Rep. 2024; 14(1):7210.
PMID: 38531899
PMC: 10966041.
DOI: 10.1038/s41598-024-57456-6.
Shen X, Lin J, Hu R, Liu Y, Xu L, Niu H
RSC Adv. 2024; 14(10):6752-6761.
PMID: 38405065
PMC: 10884790.
DOI: 10.1039/d4ra00017j.
Leakage Mechanism and Cycling Behavior of Ferroelectric AlScN.
Chen L, Wang Q, Liu C, Li M, Song W, Wang W
Materials (Basel). 2024; 17(2).
PMID: 38255566
PMC: 10817578.
DOI: 10.3390/ma17020397.
Large mechanical properties enhancement in ceramics through vacancy-mediated unit cell disturbance.
Chen Z, Huang Y, Koutna N, Gao Z, Sangiovanni D, Fellner S
Nat Commun. 2023; 14(1):8387.
PMID: 38104109
PMC: 10725508.
DOI: 10.1038/s41467-023-44060-x.
Dynamic Lone Pairs and Fluoride-Ion Disorder in Cubic-BaSnF.
Mercadier B, Coles S, Duttine M, Legein C, Body M, Borkiewicz O
J Am Chem Soc. 2023; 145(43):23739-23754.
PMID: 37844155
PMC: 10623577.
DOI: 10.1021/jacs.3c08232.
Vibrational-mechanical properties of the highly-mismatched CdBeTe semiconductor alloy: experiment and ab initio calculations.
Elmahjoubi A, Shoker M, Pages O, Torres V, Polian A, Postnikov A
Sci Rep. 2023; 13(1):14571.
PMID: 37666909
PMC: 10477277.
DOI: 10.1038/s41598-023-39248-6.
Theoretical study on structural and mechanical properties of Si-containing ternary transition metal nitrides MSiN (M = Ti, Zr, Hf).
Chen L, Xie Q, Jia Y, Yao Y
RSC Adv. 2023; 13(13):9109-9118.
PMID: 36950075
PMC: 10025939.
DOI: 10.1039/d2ra06423e.
The Electronic Disorder Landscape of Mixed Halide Perovskites.
Liu Y, Banon J, Frohna K, Chiang Y, Tumen-Ulzii G, Stranks S
ACS Energy Lett. 2023; 8(1):250-258.
PMID: 36660372
PMC: 9841609.
DOI: 10.1021/acsenergylett.2c02352.
Dynamics of the fcc-to-bcc phase transition in single-crystalline PdCu alloy nanoparticles.
Jiang Y, Duchamp M, Ang S, Yan H, Tan T, Mirsaidov U
Nat Commun. 2023; 14(1):104.
PMID: 36609570
PMC: 9822937.
DOI: 10.1038/s41467-022-35325-y.
Shry: Application of Canonical Augmentation to the Atomic Substitution Problem.
Prayogo G, Tirelli A, Utimula K, Hongo K, Maezono R, Nakano K
J Chem Inf Model. 2022; 62(12):2909-2915.
PMID: 35678099
PMC: 9241080.
DOI: 10.1021/acs.jcim.2c00389.
Hybrid-functional calculations of electronic structure and phase stability of MO (M = Zn, Cd, Be, Mg, Ca, Sr, Ba) and related ternary alloy M Zn O.
Yu J, Zhang M, Zhang Z, Wang S, Wu Y
RSC Adv. 2022; 9(15):8507-8514.
PMID: 35518688
PMC: 9061851.
DOI: 10.1039/c9ra00362b.
Exploring the sub-stoichiometric behavior of plutonium mononitride.
Lai C, Hu Y, Qiu R
RSC Adv. 2022; 10(42):24877-24881.
PMID: 35517460
PMC: 9055177.
DOI: 10.1039/d0ra00477d.
Anion order in perovskite oxynitrides AMON (A = Ba, Sr, Ca; M = Ta, Nb): a first-principles based investigation.
Xu X, Jiang H
RSC Adv. 2022; 10(41):24410-24418.
PMID: 35516175
PMC: 9055086.
DOI: 10.1039/d0ra03681a.
Equilibrium phase diagrams of isostructural and heterostructural two-dimensional alloys from first principles.
Cavin J, Mishra R
iScience. 2022; 25(4):104161.
PMID: 35434554
PMC: 9010766.
DOI: 10.1016/j.isci.2022.104161.
Using Feature-Assisted Machine Learning Algorithms to Boost Polarity in Lead-Free Multicomponent Niobate Alloys for High-Performance Ferroelectrics.
Oh S, Hwang W, Kim K, Lee J, Soon A
Adv Sci (Weinh). 2022; 9(13):e2104569.
PMID: 35253401
PMC: 9434731.
DOI: 10.1002/advs.202104569.
Ultrahigh-pressure disordered eight-coordinated phase of MgGeO: Analogue for super-Earth mantles.
Dutta R, Tracy S, Cohen R, Miozzi F, Luo K, Yang J
Proc Natl Acad Sci U S A. 2022; 119(8).
PMID: 35165195
PMC: 8872715.
DOI: 10.1073/pnas.2114424119.
Regulation of Hole Concentration and Mobility and First-Principle Analysis of Mg-Doping in InGaN Grown by MOCVD.
Zhang L, Wang R, Liu Z, Cheng Z, Tong X, Xu J
Materials (Basel). 2021; 14(18).
PMID: 34576563
PMC: 8467921.
DOI: 10.3390/ma14185339.
