A2BB´O6 Double Perovskites
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751 Index a alkali halide crystals 487 ´ A2BB O6 double perovskites alkali hydride, cubic lattice parameters 485 – B-site cation order patterns 229 alkali hydrides 487, 488 ab initio calculations 6, 111, 272 alkali-metal based 1/1 Bergman phases 47 ab initio methods 297 alkali metal antimonides 3+ 3+ 2 A B O 3 compounds – photoemissivity of 457 – classification of 226 alkali metal halide layers 581 ABX3 perovskite alkali metal hydrides 484 – cubic crystal structure of 224 alkali metals 3, 139, 140, 141, 525 – schematic drawing of 225 alkali metal suboxides 140, 147, 149, acid–base reactions 62, 674 150, 157 acoustic phonons (overdamping) 656 alkaline earth hydride crystal structures actinide hydrides 500 486 activation energies 494, 496, 514, 601 alkaline earth hydrides 479, 485, 486, 487, 488, adiabatic temperature 400 493 AeH2 cotunnite structure 486 alkaline earth ions 486 AeHx polyhedra 486 alkaline earth metal containing Ae–H coordination 486 compounds 317 AE2[ZnN2] alkaline earth metal halides 257 – crystal structures of 291 alkaline earth metal-rich systems 291 Ag–Ag interactions 43 alkaline earth metal nitrides, of transition AgPb18SbTe20 456 metals 326 AgTaN2 293 alkaline earth metal nitridocuprates 292 A- and B-site cation alkaline earth metal nitridometalates 300 – ferrimagnetic spin structure of 237 alkaline earth metals 140, 158, 443, 477, 525, A- and B-site cation-ordered perovskite 535, 537 – crystal structure of 236 – subnitrides of 150 A-type-La2O3 structure 262 alkaline earth subnitrides 157 A-site cation ordered perovskite alkali silicate 122 – crystal structure of 234 allotropes 436 A-site deficient perovskites 206 – of Ge 529 A-site lanthanide ions 227 Al-Mn-Fe-Si system 83 AlB2-structure type 444 Al-Mn-Si system 83 AlB2-type borides 441 Al–Cu network Al13(Co,Ni)4 structure 77 Al–O–P linkages 117 Al-Cu-Fe-Si system 83 Al-Pd-Mn-Si system 83 Al-Fe-Si system 83 α-Mg3Sb2 alkali borate glasses 122 – crystal structure of 457 – Mayenite with 505 α-NaFeO2- type structure 325, 574 Handbook of Solid State Chemistry, First Edition. Edited by Richard Dronskowski, Shinichi Kikkawa, and Andreas Stein. 2017 Wiley-VCH Verlag GmbH & Co. KGaA. Published 2017 by Wiley-VCH Verlag GmbH & Co. KGaA. 752 Index α-PbO2 structure 269 – correlations 633 AlPO4 segregation scenario 117 – coupling 716 Al-Re-Si system 83 – hexagonal spin cluster 629 Al-Rh-Si system 83 – interaction 414, 513 aluminum 440, 479 antiferromagnetic order 269, 628, 708 aluminum-cobalt system 76 antiferromagnetic spin clusters 628 ambient temperature VO2 structure 183 antiferromagnetic state 39, 501 ambipolar conductivity 685 antiferromagnetic transition temperature 502 amine intercalation 589 antiferromagnetic triangle 619 ammonia catalysis 505 antiferromagnetic V-O-V superexchange ammonium Rochelle salt 653 interaction 512 ammonolysis 370 antiferromagnetism 231 – preparation of 371 antiferromagnets 619 – reactions 255, 371 anti-Frenkel disorder 678 amorphous–crystalline transition 742 anti-2H-BaNiO3 274 amorphous phase-change materials (PCMs) antimonides 456, 471 – characterestics 740 – semiconductance of 465 – microscopic complexity 741 – for thermoelectric energy conversion 471 amorphous phases 740 antimony telluride (Sb2Te3) 737 – experimental probes 742 antimony, toxicity of 472 – first-principles simulations 742 antiperovskite 243, 503 AMRO. See angular magnetoresistance antipolar structure 651 oscillation (AMRO) antiprisms 460 angular dependence 610 aperiodic crystals 73 angular magnetoresistance oscillation 2/1 approximant structure 84 (AMRO) 610 aqueous chemistry 672 angular momentum 4 aristotype Li4SrN2 294 anionic conduction 364 arrangement of truncated icosahedra in the 1/1 anionic formal charge 361 Tsai-type approximant 88 anionic lattice 362 Arrhenius law 675 anionic p-phenylene derivative arsenides 456 – chemical formula of 547 arsenopyrite 463 anionic poly(p-phenylene) derivative 546 artificial ion conductors 687 anionic tetrahedral networks artificial synapses 746 – dimensionalities of 317 atom, composition 643 anion vacancy orde 233 atomic hydrogen 478, 479 anisotropic magnetic properties 447 atomic orbital (AO) 2, 3, 5, anisotropic magnetothermal properties, of 6, 7, 52 HoAlO3 single crystals 631 atomic positions and symmetry information for anisotropy 571, 630 the CCP lattice 165 anomalous Hall conductivity atomic positions and symmetry information for – scaling 608 the HCP lattice 166 antibonding (destabilizing) cation–anion atomic radii ratio 525 interactions 744 atomic size effects 57 antibonding interactions 41 atomistic simulation 741 antibonding orbitals 20, 62 Au–Sn and K–Sn COHP curves 16 antibonding peak 37 Au2O3, structure 178 antibonding states 37 aurivillius compounds 634 antiferroelectric PbZrO3 aurivillius-type structure 657 + – displacement pattern of Pb2 ions 652 aurivillius series members, structures 576 antiferromagnet 412, 415, 619 avalanche effect 681 antiferromagnetic average magnetic moment per Fe ion 415 – arrangement 598 avian magnetic compass 722 Index 753 avian magnetoreception 722 Bergman 1/1 quasi-crystalline A2X3 bixbyite approximants 45 – structures of 366 Berthollet’sches Knallsilber 272 AX2 fluorite β-Mn nitrides – structures of 366 – Al2Mo3C type 280 azide-ligand 715 β-Mn structure 76 – end-on bridge 715 β-rhombohedral boron 435 – end-to-end bridge 715 – crystal structure 436 azide (N3 ) ligand 715 – type borides 449 azido bridge 715 β-Zn4Sb3 – crystal structure of 464 b B-site cation Ba3AlO4H crystal structure 504 – crystal structure B-site cation in perovskite BaAl4 type structure 535 of 233, 238 Ba14(Ca,Sr)N6 clusters 153 B-site cation orders 230 back reaction rate 683 B-site-deficient perovskites 207 Ba16[CuN]8[Cu2N3][Cu3N4] 297 B-sublattice of spinel structure 627 baddeleyite (P21/c) unit cell for ZrO2 and B-sublattice structure (pyrochlore lattice) 627 HfO2 188 Bifidobacteria breve 721 Ba3[FeN3] 301 bifunctional molecular magnets 720 BaGa2Sb2 467 bimetallic/alloy catalysts 551 – crystal structure of 467 bimolecular rate law 682 Ba2+ ions 180 binary antimonides 456–464 Ba14LiN6 cluster 153 – early transition metal antimonides 459 ball milling 385 – late transition metal antimonides 462 Ba4[Mn3N6] 320 – main group antimonides 457 Ba6Mn20N21.5d 307 binary borides Ba5Na12 polyhedra 156 – group elements 437 Ba16[NbN4]3[Nb2N7] 319 – lanthanides 437 band ferromagnetism 705 – main group metals 436 bandgap 8, 16, 546, 744 binary hydrogen compounds 497 band insulators 426 binary intermetallic phases 56 Ba2[Ni3N2] 298 binary IV–VI compounds – crystal structure of 298 – structure map 743 Ba2[Ni2(Ni1xLix)N2] 298 binary model glasses, medium-range order Ba8[NiN]6N effects in 118 – crystal structure 297 – cation next-nearest neighbor environments barium cations 504 and spatial distributions 118 barium hydride 493 – ring-size distributions and “super-structural bar magnets 721 units 124 Barret formula 657 binary nitrides Ba8Sb4OH2 crystal structures 505 – chemical bonding 252 BaTiO3 644, 649 – crystal structures 264, 268 – temperature dependent polarization – enthalpies of 259 directions 649 – idealized crystal structures 263 4+ BaTi O2.4N0.4 structure 511 binary phase diagrams 24 Bärnighausen formalism 533 binary P2O5–GeO2 glass system 115 B-O-Al linkages 118 binary system B2O3–SiO2 114 B-O(1) sublattice consists of corner sharing binary TaN 285 B-O(1) octahedra 194 binary TMO with ideal rutile structure 182 bcc Jones zone 30 binary TM oxides bcc solid solution 267 – MO, with NaCl structure 170 Bergman-type clusters 81 binary transition metal nitrides 251 754 Index binary transition metals 252, 464 boron-rich metal borides 436 – nitrides, synthesis of 251, 252, 258, 260 boron-rich solids 446 binary Zn3N2 272 boron–oxygen compounds 438 biogenic magnetism 720–723 boron nitride 443 – magnetotactic bacteria 721 boron oxide 113, 439 biogenic magnetite 722 bottom of conducting band (BCB) 546 biomineralization 721 Bragg reflections 633 bioplatforms 721 Bravais lattice 30, 32 Bi95Sb5 458 bridging ligands 704 Bi2SiO5 657 bridging oxygen atoms 544 – ferrielectric-like arrangement of dipole Bridgman methods 256 moments 657 Brillouin zone 656 – vs. Bi2WO6 657 brittleness 500 bismuth Aurivillius phases 244 brookite (TiO2) showing channels 186 bismuthides 456 Brønsted acid–base picture 671 Bi2Te3 Brønsted acids 577, 587 – superlattices of 456 Brønsted concept 668 Bi4Ti3O12 structure 574 Brønsted-type basic sites 549 Bi2WO6 657 Brønsted level 671 bixbyites 190, 365 Brouwer approximation 673 ´ Bloch states 609 brownmillerite, A2BB O5, structure 209 boat-like conformation 445 brownmillerite-type A2B2O5 body-centered tetragonal structure 38 – crystal structure of 239 Bohr magneton 597 brownmillerites 207 Boltzmann conditions 673 – structure 210 Boltzmann constant 661 – type 239 Boltzmann equations 596, 598 brucite 584 Boltzmann statistics 672 – distortion of 542 bond angle distribution 112 – structure of 542 bond angles 27 B/Si ratio 116 bond valence sums (BVS) 488 bulk defects 686 borate glasses 95, 120 bulk sensors 715 boric acid 438 Butler–Volmer equation 685 boride – synthesis 439 c boride crystals 440 Ca7Ag2.72N4 330 boride materials 439 Ca@Ag18 polyhedra borides 435, 442 – chemical pressure 59 – icosahedra 448 CaAgSb 466 – synthesis 439 – crystal structures of 466 –– nanomaterials 440 Ca3AlSb3 468 –– powder preparation 439 – crystal structures of 468 –– single-crystal growth 439 Ca5Al2Sb6 Born-Mayer potentials 146 – crystal structures of 470 boron 435 Ca14AlSb11 470 – allotropes 435 CaAl2Si2 466 – atom arrangement, in metallic