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- W3100594779 abstract "We report the crystal structures and magnetic properties of two psuedo-polymorphs of the $S=1/2$ Ti$^{3+}$ coordination framework, KTi(C$_2$O$_4$)$_2cdot$xH$_2$O. Single-crystal X-ray and powder neutron diffraction measurements on $alpha$-KTi(C$_2$O$_4$)$_2cdot$xH$_2$O confirm its structure in the tetragonal $I4/mcm$ space group with a square planar arrangement of Ti$^{3+}$ ions. Magnetometry and specific heat measurements reveal weak antiferromagnetic interactions, with $J_1approx7$ K and $J_2/J_1=0.11$ indicating a slight frustration of nearest- and next-nearest-neighbor interactions. Below $1.8$ K, $alpha$ undergoes a transition to G-type antiferromagnetic order with magnetic moments aligned along the $c$ axis of the tetragonal structure. The estimated ordered moment of Ti$^{3+}$ in $alpha$ is suppressed from its spin-only value to $0.62(3)~mu_B$, thus verifying the two-dimensional nature of the magnetic interactions within the system. $beta$-KTi(C$_2$O$_4$)$_2cdot$2H$_2$O, on the other hand, realises a three-dimensional diamond-like magnetic network of Ti$^{3+}$ moments within a hexagonal $P6_222$ structure. An antiferromagnetic exchange coupling of $Japprox54$ K -- an order of magnitude larger than in $alpha$ -- is extracted from magnetometry and specific heat data. $beta$ undergoes N'eel ordering at $T_N=28$ K, with the magnetic moments aligned within the $ab$ plane and a slightly reduced ordered moment of $0.79~mu_B$ per Ti$^{3+}$. Through density-functional theory calculations, we address the origin of the large difference in the exchange parameters between the $alpha$ and $beta$ psuedo-polymorphs. Given their observed magnetic behaviors, we propose $alpha$-KTi(C$_2$O$_4$)$_2cdot$xH$_2$O and $beta$-KTi(C$_2$O$_4$)$_2cdot$2H$_2$O as close to ideal model $S=1/2$ Heisenberg square and diamond lattice antiferromagnets, respectively." @default.
- W3100594779 created "2020-11-23" @default.
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- W3100594779 date "2020-10-23" @default.
- W3100594779 modified "2023-09-27" @default.
- W3100594779 title "Realizing square and diamond lattice <mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML><mml:mrow><mml:mi>S</mml:mi><mml:mo>=</mml:mo><mml:mn>1</mml:mn><mml:mo>/</mml:mo><mml:mn>2</mml:mn></mml:mrow></mml:math> Heisenberg antiferromagnet models in the <mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML><mml:mi>α</mml:mi></mml:math> and <mml:math xmlns:mml=http://www.w3.org/1998/Math/MathML><mml:mi>β</mml:mi></mml:math> phases of the coordination framework, <mml:math xmlns:mml=http…" @default.
- W3100594779 cites W1518233051 @default.
- W3100594779 cites W1554102841 @default.
- W3100594779 cites W1827528477 @default.
- W3100594779 cites W1840087123 @default.
- W3100594779 cites W1966645781 @default.
- W3100594779 cites W1967957616 @default.
- W3100594779 cites W1969360633 @default.
- W3100594779 cites W1974130935 @default.
- W3100594779 cites W1974378834 @default.
- W3100594779 cites W1979088495 @default.
- W3100594779 cites W1988098580 @default.
- W3100594779 cites W1998981899 @default.
- W3100594779 cites W2000073590 @default.
- W3100594779 cites W2002457216 @default.
- W3100594779 cites W2004561363 @default.
- W3100594779 cites W2005746060 @default.
- W3100594779 cites W2007082137 @default.
- W3100594779 cites W2007153107 @default.
- W3100594779 cites W2008839109 @default.
- W3100594779 cites W2009011326 @default.
- W3100594779 cites W2010974419 @default.
- W3100594779 cites W2016820165 @default.
- W3100594779 cites W2020582691 @default.
- W3100594779 cites W2022498039 @default.
- W3100594779 cites W2023532255 @default.
- W3100594779 cites W2028056984 @default.
- W3100594779 cites W2028973576 @default.
- W3100594779 cites W2036771236 @default.
- W3100594779 cites W2036896274 @default.
- W3100594779 cites W2037694748 @default.
- W3100594779 cites W2038530321 @default.
- W3100594779 cites W2047405498 @default.
- W3100594779 cites W2049079467 @default.
- W3100594779 cites W2049126606 @default.
- W3100594779 cites W2051181702 @default.
- W3100594779 cites W2055704623 @default.
- W3100594779 cites W2057197039 @default.
- W3100594779 cites W2057265219 @default.
- W3100594779 cites W2059188702 @default.
- W3100594779 cites W2062597409 @default.
- W3100594779 cites W2066509926 @default.
- W3100594779 cites W2071167823 @default.
- W3100594779 cites W2073174587 @default.
- W3100594779 cites W2078154736 @default.
- W3100594779 cites W2078436527 @default.
- W3100594779 cites W2090582541 @default.
- W3100594779 cites W2095241815 @default.
- W3100594779 cites W2096703070 @default.
- W3100594779 cites W2101116992 @default.
- W3100594779 cites W2103279820 @default.
- W3100594779 cites W2132216432 @default.
- W3100594779 cites W2132454074 @default.
- W3100594779 cites W2134001588 @default.
- W3100594779 cites W2159793353 @default.
- W3100594779 cites W2171376707 @default.
- W3100594779 cites W2207554270 @default.
- W3100594779 cites W2268953711 @default.
- W3100594779 cites W2306579551 @default.
- W3100594779 cites W2384098731 @default.
- W3100594779 cites W2559245972 @default.
- W3100594779 cites W2586438918 @default.
- W3100594779 cites W2606291201 @default.
- W3100594779 cites W2723072434 @default.
- W3100594779 cites W2790892446 @default.
- W3100594779 cites W2799097074 @default.
- W3100594779 cites W2805678085 @default.
- W3100594779 cites W2884446814 @default.
- W3100594779 cites W2904374207 @default.
- W3100594779 cites W2916894942 @default.
- W3100594779 cites W2917832775 @default.
- W3100594779 cites W2921000805 @default.
- W3100594779 cites W2932963941 @default.
- W3100594779 cites W2934898094 @default.
- W3100594779 cites W2948762078 @default.
- W3100594779 cites W2950028665 @default.
- W3100594779 cites W2952735906 @default.
- W3100594779 cites W2954402478 @default.
- W3100594779 cites W3037656731 @default.
- W3100594779 cites W3098231154 @default.
- W3100594779 cites W3099183275 @default.
- W3100594779 cites W3103546924 @default.
- W3100594779 cites W4248052365 @default.
- W3100594779 cites W599757042 @default.
- W3100594779 cites W2052861491 @default.
- W3100594779 doi "https://doi.org/10.1103/physrevmaterials.4.104414" @default.