2021

T Gasser et al. (2021) Structural characterization of ice XIX as the second polymorph related to ice VI. Nature Comm. 12, article 1128. doi: 10.1038/s41467-021-21161-z​ / data: 10.5286/ISIS.E.RB2000132  / Science Highlight​​

AI Waidha et al. (2021) ​Structural, magnetic and catalytic properties of a new vacancy ordered perovskite type barium cobaltate BaCoO_2.67. Chem. Eur. J. doi: 10.1002/chem.202101167

​S Mallick et al. (2021) Switching between proper and hybrid-improper polar structures via cation ​substitution in A₂La(TaTi)O₇ (A = Li, Na). Chem. Mater. 33, 2666–2672. doi: 10.1021/acs.chemmater.1c00599

C de Leeuwe et al. (2021) Revisiting the thermal and chemical expansion and stability of La_0.6Sr_0.4FeO_3-δ. J. Solid. State. Chem. 293, article 121838. doi: 10.1016/j.jssc.2020.121838 / data: 10.5286/ISIS.E.86390351

GW Howieson et al. (2021) Structural phase transitions in the geometric ferroelectric LaTaO₄. Phys. Rev. B 103, article 014119. doi: 10.1103/PhysRevB.103.014119

Z. An et al. (2021) Multiple structural components and their competition in the intermediate state of antiferroelectric Pb(Zr,Ti)O₃. Phys. Rev. B. 103, article 054113. doi: 10.1103/PhysRevB.103.054113

M. Alnajjar et al. (2021) In-situ neutron diffraction study of wrought and selective laser melted maraging stainless steels. Mater. Character. 172, article 110840. doi: 10.1016/j.matchar.2020.110840

S Fop et al. (2021) Hydration and ionic conduction mechanisms of hexagonal perovskite derivatives. Chem. Mater. 33, 4651–4660. doi: 10.1021/acs.chemmater.1c01141​​

2020​

L del Rosso et al. (2020) Cubic ice Ic without stacking defects obtained from ice XVII. Nature Mat. 19, 663–668 doi: 10.1038/s41563-020-0606-y​ / data: 10.5286/ISIS.E.9969135​5 / Science Highlight​ / View-only version of the paper​

M. Li et al. (2020) A CO2‐Tolerant Perovskite Oxide with High Oxide Ion and Electronic Conductivity​. Advanced Materials. 32, article 1905200. doi: 10.1002/adma.201905200

C Larsen et al. (2020) ​Basal plane ferromagnetism in the rhombohedral manganite La_0.85Ag_0.15MnO_3+d. J. Magnetism Magnetic Mater. 498, article 166192. doi: 10.1016/j.jmmm.2019.166192 / data: 10.5286/ISIS.E.82320816

T. Simm et al. (2020) The τ-plot, a multicomponent 1-D pole figure plot, to quantify the heterogeneity of plastic deformation. Mater. Character. 2020, article 110114. doi: 10.1016/j.matchar.2019.110114 / data: 10.5286/ISIS.E.98995785​

K. Wissel et al. (2020) Topochemical Fluorination of n = 2 Ruddlesden–Popper Type Sr3Ti2O7 to Sr3Ti2O5F4 and Its Reductive Defluorination​. Inorg. Chem. 59, 1153–1163 doi: 10.1021/acs.inorgchem.9b02783​

A J Browne & J P Attfield (2020) Orbital molecules in vanadium oxide spinels. Phys. Rev. B 101, article 24112. doi: 10.1103/PhysRevB.101.024112 / data: 10.5286/ISIS.E.82320816

H Jacobsen et al. (2020) Magnetically induced metal-insulator transition in Pb₂CaOsO₆. Phys. Rev. B. 102, article 214409.

AD Fortes (2020) Co-crystals, salts and ionic co-crystals of ethanol and ammonia. ACS Earth. Space. Chem. 4, 1612–1625. doi: 10.1021/acsearthspacechem.0c00155 / data: 10.5286/ISIS.E.95699847

AD Fortes (2020) Phenol hemihydrate: redetermination of the crystal structure by neutron powder diffraction , Hirschfeld surface analysis and characterization of the thermal expansion. Acta Cryst. E 76, 1062–1069. doi: 10.1107/S2056989020007719 / data: 10.5286/ISIS.E.RB1920009​

AD Fortes et al. (2020) On the structures and phase transitions of hydrates in the binary dimethyl sulfoxide - water ​system. Acta Cryst. B 76, 733–748. doi: 10.1107/S2052520620008999 / data: 10.5286/ISIS.E.RB1910297

H Zhang et al. (2020) Structure and dielectric properties of double A-site doped bismuth sodium titanate relaxor ferroelectrics for high power energy storage applications. J. Mater. Chem. A. 8, 23965–23973.

AH Abdeldaim et al. (2020) Realizing square and diamond lattice S = 1/2 Heisenberg antiferroelectric models in the alpha and beta phases of the coordination framework, KTi(C₂O₄)₂.xH₂O. Phys. Rev. Materials. 4, article 104414.

2019

​L Clark et al. (2019) Two-dimensional spin liquid behaviour in the triangular-honeycomb antiferromagnet TbInO3. Nature Physics 15, 262–268. doi: 10.1038/s41567-018-0407-2 / data: 10.5286/ISIS.E.58450984 / Science Highlight

J A McNulty et al. (2019) ​An Electronically Driven Improper Ferroelectric: Tungsten Bronzes as Microstructural Analogs for the Hexagonal Manganites. Advanced Materials. 31, article 1903620. doi: 10.1002/adma.201903620​ / data: 10.5286/ISIS.E.RB1510025 ​/ data: 10.5286/ISIS.1 / Science Highlight​​

C J Ridley et al. (2019) High-pressure study of the elpasolite perovskite La2NiMnO6. Inorg. Chem. 58, 9016–9027. doi:10.1021/acs.inorgchem.9b00404 / data: doi: 10.5286/ISIS.E.49914145 (HRPD) / data: 10.5286/ISIS.E.49915536 (PEARL) / Science Highlight​

A D Fortes (2019) Structural manifestation of partial proton ordering and defect mobility in ice Ih. Phys. Chem. Chem. Phys. 2019, 21, 8264–8274. doi: 10.1039/C9CP01234F / data: 10.5286/ISIS.E.95699847 / data: 10.5286/ISIS.E.98018903​ / Science Highlight​

J A McNulty et al. (2019) Octahedral tilting in the polar hexagonal tungsten bronzes RbNbW₂O₉ and KNbW₂O₉. Acta Crystallogr. B 75. doi: 10.1107/S2052520619009260​  / data: 10.5286/ISIS.E.RB1710021

R H Jones et al. (2019) The th​ermal expansion properties of halogen bond containing 1,4 dioxane halogen complexes​. CrystEngComm. 21, 5269–5277. doi: 10.1039/C9CE00803A​ / ​da​ta: 10.5286/ISIS.E.55377624​​​

T Yang et al. (2019) Ca₂PbGa₈O₁₅: Rational Design, Synthesis, and Structure Determination of a Purely Tetrahedra-based Intergrowth Oxide. Angew. Chem. Int. Ed. 58, 5978–5982. doi: 10.1002/anie.201901373

Diaz-Lopez et al. (2019) Interstitial oxide ion conductivity in the langasite structure: carrier trapping by formation of (Ga,Ge)₂O₈ units in La₃Ga_5-xGe_1+xO_14+x/2 (0 < x < 1.5). Chem. Mater. 31, 5742–5758. doi: 10.1021/acs.chemmater.9b01734 / data: 10.5286/ISIS.E.24089314

Y Guo et al. (2019) Unexpected phase transition sequence in the ferroelectric Bi₄Ti₃O₁₂. IUCrJ 6, 438–446. doi: 10.1107/S2052252519003804 / data: 10.5286/ISIS.E.

RB1720034

Li₃AlS₃, in the Li-Al-S phase field: structure and lithium conductivity​. Chem. Mater. 31, 9699–9714. doi: 10.1021/acs.chemmater.9b03230 / data: 10.5286/ISIS.E.99680726

I Qasim et al. (2019) Crystal structures and electronic properties in 3d transition metal doped SrRuO₃. Dalton Trans. 2019, 48, 4730–4741. doi: 10.1039/C9DT00432G / data: 10.5286/ISIS.E.24079300

Z A Mikhaylovskaya et al. (2019) ​High-Temperature Studies of the Structure of Complex Oxides Based on Bi₂₆Mo₁₀O_69–d​. Journal of Structural Chemistry 59, 2001–2010. doi: 10.1134/S0022476618080334 / data: 10.5286/ISIS.E.42591720

E Liotti et al. (2019) Synchrotron X-ray and neutron investigation of the structure and thermal expansion of the monoclinic Al₁₃Cr₂ phase​. J Alloys & Compounds 781, 1198–1208. doi: 10.1016/j.jallcom.2018.12.132 / RB 810262

S R Popuri et al. (2019) Phonon-glass and heterogeneous electrical transport in A-site-deficient SrTiO₃. J. Phys. Chem. C 123, 5198–5208. doi: 10.1021/acs.jpcc.8b10520 / data: 10.5286/ISIS.E.6

3527800

A I Waidha et al. (2019) BaCoO_2+d: a new highly oxygen deficient perovskite-related phase with unusual Co coordination obtained by high temperature reaction with short reaction times. Chem. Commun. 55, 2920–2923. doi: 10.1039/C8CC09532A / data: 10.5286/ISIS.E.87849379

A D Fortes et al. (2019) Thermoelastic properties of deuterated melamine, C₃N₆D₆, between 4.2 - 320 K at 5 kPa and between 0.1 - 5.0 GPa at 295 K from neutron powder diffraction and DFT calculations. High Press. Res. 39, 160–178. doi: 10.1080/08957959.2019.1578879 / data: 10.5286/ISIS.E.91922702 / data: 10.5286/ISIS.E.90605896

A D Fortes (2019) Thermal expansion of the Al₂SiO₅ polymorphs, kyanite, andalusite and sillimanite, between 10 and 1573 K determined using time-of-flight neutron powder diffraction. Phys. Chem. Min. 46, 687–704. doi: 10.1007/s00269-019-01031-3 / data: 10.5286/ISIS.E.83382292

S J Cassidy et al. (2019) Layered CeSO and LiCeSO oxide chalcogenides obtained via topotactic oxidative and reductive transformations. Inorg. Chem. 58, 3838–3850. doi: 10.1021/acs.inorgchem.8b03485 / data: 10.5286/ISIS.E.24079460 / data: 10.5286/ISIS.E.24081489

V Peçanha-Antonio et al. (2019) Intermultiplet transitions and magnetic long-range order in Sm-based pyrochlores. Phys. Rev. B 99, 134415. doi: 10.1103/PhysRevB.99.134415 / data: 10.5286/ISIS.E.86387609

Z N Taylor et al. (2019) Stabilization of O-O bonds by d⁰ cations in Li_4+xNi_1-xWO₆ (0 ≤ x ≤ 0.25) rocksalt oxides as the origin of large voltage hysteresis. J. Am. Chem. Soc. 141, 7333–7346. doi: 10.1021/jacs.8b13633

J Sannigrahi et al. (2019) First-order valence transition: neutron diffraction, inelastic neutron scattering, and x-ray absorption investigations on the double perovskite Ba₂PrRu_0.9Ir_0.1O₆. Phys. Rev. B 99, 184440. doi: 10.1103/PhysRevB.99.184440 / RB 13998 & 15080 + RB 14882 (HET).

M S Chambers et al. (2019) Average and Local Structure of Apatite-Type Germanates and Implications for Oxide Ion Conductivity​. Inorg. Chem. 58, 14853–14862. doi: 10.1021/acs.inorgchem.9b02544 / data: 10.5286/ISIS.E.RB1610106 / data: 10.5286/ISIS.E.RB1610105

A H Abdeldaim et al. (2019) Large easy-axis anisotropy in the one-dimensional magnet BaMo(PO₄)₂​. Phys. Rev. B 100, article 214427. doi: 10.1103/PhysRevB.100.214427​

C M Howard (2019) The NH₃ + CO₂ ± H₂O ternary system. PhD Thesis, University College London. data: 10.5286/ISIS.E.55377240 / data: 10.5286/ISIS.E.83551029 / data: 10.5286/ISIS.E.86388469 / data: 10.5286/ISIS.E.90604738

S Nuzzo (2019) Uranium thiocyanate compounds in multiple oxidation states. PhD Thesis, Trinity College Dublin. data: 10.5286/ISIS.E.89608894

D Beqiri (2019) Synthesis and characterisation of A-site deficient ordered perovskites. MScRes Thesis, University of Kent.​
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