Role of Acentric Displacements on the Crystal Structure and Second-Harmonic Generating Properties of RbPbCO3F and CsPbCO3F
Two lead fluorocarbonates, RbPbCO3F and CsPbCO3F, were synthesized and
characterized. The materials were synthesized through solvothermal and conventional solid …
characterized. The materials were synthesized through solvothermal and conventional solid …
Observation of Multiple Crystal-to-Crystal Transitions in a New Reduced Vanadium Oxalate Hybrid Material, Ba3[(VO)2(C2O4)5(H2O)6]·(H2O)3, Prepared …
D Abeysinghe, MD Smith, J Yeon… - Crystal Growth & …, 2014 - ACS Publications
A new reduced vanadium oxalate, Ba3 [(VO) 2 (C2O4) 5 (H2O) 6]·(H2O) 3, 1, was
synthesized via a two-step, mild hydrothermal method using oxalic acid as the reducing …
synthesized via a two-step, mild hydrothermal method using oxalic acid as the reducing …
Crystal growth of four oxovanadium (IV) tartrates prepared via a mild two-step hydrothermal method: Observation of spin-dimer behavior and second harmonic …
AJ Cortese, B Wilkins, MD Smith, J Yeon… - Inorganic …, 2015 - ACS Publications
Four new oxovanadium (IV) tartrates, namely, A2 [(VO) 2 (C4H4O6)(C4H2O6)(H2O)
2]·(H2O) 2, where A= Cs, 1, Rb, 2; K2 [(VO) 2 (C4H2O6) 2 (H2O) 2]·(H2O) 2, 3; and Na2 …
2]·(H2O) 2, where A= Cs, 1, Rb, 2; K2 [(VO) 2 (C4H2O6) 2 (H2O) 2]·(H2O) 2, 3; and Na2 …
EQeq+ C: an empirical bond-order-corrected extended charge equilibration method
GC Martin-Noble, D Reilley, LM Rivas… - Journal of chemical …, 2015 - ACS Publications
The extended charge equilibration (EQeq) scheme computes atomic partial charges using
the experimentally measured ionization potentials and electron affinities of atoms. However …
the experimentally measured ionization potentials and electron affinities of atoms. However …
Organically templated metal phosphate-oxalates: Solvent-free synthesis, crystal structure, and proton conduction
Y Cao, X Zhou, L Luan, H Zeng, G Zou, Z Lin - Inorganic Chemistry …, 2021 - Elsevier
Two new metal phosphate-oxalates, namely, H 2 api· Mn 2 (H 2 PO 4) 2 (C 2 O 4) 2 (1) and
H 2 mpip⋅ Sc (H 2 PO 4) 2 (C 2 O 4)· 0.5 C 2 O 4· 1.5 H 2 O (2), were prepared under …
H 2 mpip⋅ Sc (H 2 PO 4) 2 (C 2 O 4)· 0.5 C 2 O 4· 1.5 H 2 O (2), were prepared under …
[NaCl][Cu(HSeO3)2], NaCl-intercalated Cu(HSeO3)2: synthesis, crystal structure and comparison with related compounds
VM Kovrugin, SV Krivovichev, O Mentré… - Zeitschrift für …, 2015 - degruyter.com
Abstract Single crystals of [NaCl][Cu (HSeO3) 2] have been prepared by the chemical vapor
transport reactions. Its crystal structure (monoclinic, C 2/c, a= 13.9874 (7), b= 7.2594 (4), c …
transport reactions. Its crystal structure (monoclinic, C 2/c, a= 13.9874 (7), b= 7.2594 (4), c …
Understanding structural adaptability: a reactant informatics approach to experiment design
RJ Xu, JH Olshansky, PDF Adler, Y Huang… - … Systems Design & …, 2018 - pubs.rsc.org
The structural and electronic adaptability ranges of a [VO (SeO3)(HSeO3)] framework found
in organically templated vanadium selenites were determined using a three step approach …
in organically templated vanadium selenites were determined using a three step approach …
Role of noncovalent interactions in vanadium tellurite chain connectivities
A Nourmahnad, MD Smith, M Zeller… - Inorganic …, 2015 - ACS Publications
Structural differences in [V2Te2O10] n 2 n–chain metrics are directly ascribed to variations in
noncovalent interactions in a series of organically templated vanadium tellurites, including …
noncovalent interactions in a series of organically templated vanadium tellurites, including …
New Lanthanide Mixed-Valent Vanadium(III/IV) Oxosilicates, Ln4V5–xZnxSi4O22 (Ln = La, Ce, Pr, and Nd), Crystallizing in a Quasi Two-Dimensional Rutile …
D Abeysinghe, MD Smith, J Yeon, G Morrison… - Inorganic …, 2016 - ACS Publications
A family of lanthanide mixed-valent vanadium (III/IV) oxosilicates Ln4V5–x Zn x Si4O22 (Ln=
La, Ce, Pr, and Nd) was synthesized as high-quality single crystals via a high-temperature …
La, Ce, Pr, and Nd) was synthesized as high-quality single crystals via a high-temperature …
Probing structural adaptability in templated vanadium selenites
The structural adaptability of [V 3 O 5 (SeO 3) 3] n 2 n− layers in organically templated
vanadium selenites was determined using a three step approach involving (i) an 84 reaction …
vanadium selenites was determined using a three step approach involving (i) an 84 reaction …