Unprecedented Lanthanide-Containing Coordination Polymers Constructed from Hexanuclear Molecular Building Blocks: {[Ln6O(OH)8](NO3)2(bdc)(Hbdc)2·2NO3·H2bdc}∞

2011 ◽  
Vol 50 (7) ◽  
pp. 2851-2858 ◽  
Author(s):  
Guillaume Calvez ◽  
Carole Daiguebonne ◽  
Olivier Guillou
Keyword(s):  
Coordination Polymers ◽  
Building Blocks ◽  
Molecular Building Blocks

Rhenium–Chalcogenide–Cyano Clusters, Cu2+ Ions, and 1,2,3,4-Tetraaminobutane as Molecular Building Blocks for Chiral Coordination Polymers

2004 ◽  
Vol 43 (10) ◽  
pp. 1297-1300 ◽  
Author(s):  
Yuri V. Mironov ◽  
Nikolai G. Naumov ◽  
Konstantin A. Brylev ◽  
Olga A. Efremova ◽  
Vladimir E. Fedorov ◽  
...  
Keyword(s):  
Coordination Polymers ◽  
Building Blocks ◽  
Molecular Building Blocks

A First Principles Approach for Partitioning Linear Response Properties into Additive and Cooperative Contributions

2018 ◽  
Author(s):  
Daniel Lambrecht ◽  
Eric Berquist
Keyword(s):  
First Principles ◽  
Linear Response ◽  
Building Blocks ◽  
Field Method ◽  
Response Property ◽  
Response Properties ◽  
Consistent Field ◽  
Molecular Building Blocks ◽  
Self Consistent ◽  
Self Consistent Field

We present a first principles approach for decomposing molecular linear response properties into orthogonal (additive) plus non-orthogonal/cooperative contributions. This approach enables one to 1) identify the contributions of molecular building blocks like functional groups or monomer units to a given response property and 2) quantify cooperativity between these contributions. In analogy to the self consistent field method for molecular interactions, SCF(MI), we term our approach LR(MI). The theory, implementation and pilot data are described in detail in the manuscript and supporting information.

A new molecular building blocks: Synthesis, crystal structure, magnetic and spectroscopic properties of Cu(II) and Ni(II) macrocyclic complexes

Polyhedron ◽  
2011 ◽  
Vol 30 (15) ◽  
pp. 2550-2557 ◽  
Author(s):  
Katarzyna Suracka ◽  
Alina Bieńko ◽  
Jerzy Mroziński ◽  
Rafał Kruszyński ◽  
Dariusz Bieńko ◽  
...  
Keyword(s):  
Crystal Structure ◽  
Building Blocks ◽  
Spectroscopic Properties ◽  
Macrocyclic Complexes ◽  
Molecular Building Blocks
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