Recent developments in the methods and applications of the bond valence model
ID Brown - Chemical reviews, 2009 - ACS Publications
The bond valence model was described comprehensively in my 2002 book, The Chemical
Bond in Inorganic Chemistry: The Bond Valence Model, 1 where references to earlier work …
Bond in Inorganic Chemistry: The Bond Valence Model, 1 where references to earlier work …
A review of the structural architecture of tellurium oxycompounds
Relative to its extremely low abundance in the Earth's crust, tellurium is the most
mineralogically diverse chemical element, with over 160 mineral species known that contain …
mineralogically diverse chemical element, with over 160 mineral species known that contain …
SoftBV–a software tool for screening the materials genome of inorganic fast ion conductors
H Chen, LL Wong, S Adams - Acta Crystallographica Section B …, 2019 - journals.iucr.org
The identification of materials for advanced energy-storage systems is still mostly based on
experimental trial and error. Increasingly, computational tools are sought to accelerate …
experimental trial and error. Increasingly, computational tools are sought to accelerate …
[PDF][PDF] Comprehensive derivation of bond-valence parameters for ion pairs involving oxygen
Published two-body bond-valence parameters for cation–oxygen bonds have been
evaluated via the root mean-square deviation (RMSD) from the valence-sum rule for 128 …
evaluated via the root mean-square deviation (RMSD) from the valence-sum rule for 128 …
[BOEK][B] The chemical bond in inorganic chemistry: the bond valence model
ID Brown - 2016 - books.google.com
The bond valence model, a description of acid-base bonding, is widely used for analysing
and modelling the structures and properties of solids and liquids. Unlike other models of …
and modelling the structures and properties of solids and liquids. Unlike other models of …
[HTML][HTML] On the effective ionic radii for the tin (II) cation
V Sidey - Journal of Physics and Chemistry of Solids, 2022 - Elsevier
Based on the bond valence (s)–bond length (d) correlation curve accurately approximated
for the Sn 2+/F− ion pair using the equation s= exp [(r 0–d)/b](where the optimized bond …
for the Sn 2+/F− ion pair using the equation s= exp [(r 0–d)/b](where the optimized bond …
The Crystal Structure of Pb10(PO4)6O Revisited: The Evidence of Superstructure
SV Krivovichev, G Engel - Crystals, 2023 - mdpi.com
The crystal structure of Pb10 (PO4) 6O, the proposed matrix for the potential room-
temperature superconductor LK-99, Pb10− xCux (PO4) 6O (x= 0.9–1.0), has been …
temperature superconductor LK-99, Pb10− xCux (PO4) 6O (x= 0.9–1.0), has been …
Revised values of the bond-valence parameters for TeIV—O, TeVI—O and TeIV—Cl
Bond-valence parameters r0 and b have been re-determined for TeIV—O: r0= 1.9605 Å, b=
0.41; TeVI—O: r0= 1.921 Å, b= 0.56; and TeIV—Cl: r0= 2.3115 Å, b= 0.555. Bond distance …
0.41; TeVI—O: r0= 1.921 Å, b= 0.56; and TeIV—Cl: r0= 2.3115 Å, b= 0.555. Bond distance …
XRD, NMR, FT-IR and DFT structural characterization of a novel organic-inorganic hybrid perovskite-type hexabromotellurate material
The synthesis of a new hexabromotellurate of triazole ring-containing amino acid is
described. XRD, NMR and DFT analysis of the structure of protonated [(5-amino-4-phenyl-4 …
described. XRD, NMR and DFT analysis of the structure of protonated [(5-amino-4-phenyl-4 …
Crystal chemistry of lead oxide phosphates: crystal structures of Pb4O(PO4)2, Pb8O5(PO4)2 and Pb10(PO4)6O
Crystals of three Pb oxide phosphates, Pb4O (PO4) 2, Pb8O5 (PO4) 2 and Pb10 (PO4) 6O,
were synthesized from mixtures of PbO and NH4H2PO4 heated to 950° C. The crystal …
were synthesized from mixtures of PbO and NH4H2PO4 heated to 950° C. The crystal …