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Crystal Field Theory - Tetrahedral and Square Planar Complexes02:46

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Tetrahedral Complexes
Crystal field theory (CFT) is applicable to molecules in geometries other than octahedral. In octahedral complexes, the lobes of the dx2−y2 and dz2 orbitals point directly at the ligands. For tetrahedral complexes, the d orbitals remain in place, but with only four ligands located between the axes. None of the orbitals points directly at the tetrahedral ligands. However, the dx2−y2 and dz2 orbitals (along the Cartesian axes) overlap with the ligands less than the dxy,...
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Isomerism in Complexes
Isomers are different chemical species that have the same chemical formula. Structural isomerism of coordination compounds can be divided into two subcategories, the linkage isomers and coordination-sphere isomers.
Linkage isomers occur when the coordination compound contains a ligand that can bind to the transition metal center through two different atoms. For example, the CN− ligand can bind through the carbon atom or through the nitrogen atom. Similarly, SCN− can...
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Coordination compounds and complexes exhibit different colors, geometries, and magnetic behavior, depending on the metal atom/ion and ligands from which they are composed. In an attempt to explain the bonding and structure of coordination complexes, Linus Pauling proposed the valence bond theory, or VBT, using the concepts of hybridization and the overlapping of the atomic orbitals. According to VBT, the central metal atom or ion (Lewis acid) hybridizes to provide empty orbitals of suitable...
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Characteristics and Nomenclature of Homopolymers01:00

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Polymers that are made up of identical monomer units are called homopolymers. Only one repeating unit is involved in the construction of the homopolymer structure. For example, as depicted in Figure 1, polypropylene is a homopolymer constituted of propylene monomers. Here, the only repeating unit in the polymer chain is propylene.
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In the application of the Routh-Hurwitz criterion, two specific scenarios can arise that complicate stability analysis.
The first scenario occurs when a singular zero appears in the first column of the Routh table. This situation creates a division by zero issues. To resolve this, a small positive or negative number, denoted as epsilon (∈), is substituted for the zero. The stability analysis proceeds by assuming a sign for ∈. If ∈ is positive, any sign change in the first...
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Stereoisomerism02:52

Stereoisomerism

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Isomerism in Complexes
Isomers are different chemical species that have the same chemical formula.
Transition metal complexes often exist as geometric isomers, in which the same atoms are connected through the same types of bonds but with differences in their orientation in space. Coordination complexes with two different ligands in the cis and trans positions from a ligand of interest form isomers. For example, the octahedral [Co(NH3)4Cl2]+ ion has two isomers (Figure 1) In the cis...
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Related Experiment Video

Updated: Jul 1, 2025

Construction and Systematical Symmetric Studies of a Series of Supramolecular Clusters with Binary or Ternary Ammonium Triphenylacetates
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Higher-order homophily on simplicial complexes.

Arnab Sarker1, Natalie Northrup2, Ali Jadbabaie1,2

  • 1Institute for Data, Systems, and Society, Massachusetts Institute of Technology, Cambridge, MA 02139.

Proceedings of the National Academy of Sciences of the United States of America
|March 12, 2024
PubMed
Summary

Higher-order network analysis requires new homophily measures. We introduce simplicial homophily to accurately assess group interactions, revealing hidden patterns in complex systems.

Keywords:
higher-orderhomophilynetworkssimplicial complexes

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Area of Science:

  • Network Science
  • Sociology
  • Data Analysis

Background:

  • Higher-order network models capture multi-entity interactions, crucial for complex systems.
  • Homophily, the tendency for similar entities to connect, is well-studied in pairwise networks.
  • Existing homophily measures struggle with higher-order interactions, often masking true patterns.

Purpose of the Study:

  • To develop a novel measure of homophily for higher-order networks.
  • To decouple pairwise homophily from higher-order homophily.
  • To investigate the role of homophily in higher-order link prediction.

Main Methods:

  • Defined simplicial homophily for networks modeled as simplicial complexes.
  • Validated the measure theoretically using a stochastic block model for simplicial complexes.
  • Empirically tested the measure on 16 large-scale datasets.

Main Results:

  • Standard homophily measures inflate higher-order results due to pairwise effects.
  • Simplicial homophily accurately distinguishes pairwise from higher-order homophily.
  • The measure can identify when node features are predictive in higher-order networks.

Conclusions:

  • Simplicial homophily provides a more accurate understanding of group dynamics in complex systems.
  • Node feature importance in higher-order networks is nuanced and depends on interaction order.
  • This work offers a refined approach to analyzing higher-order network structures and properties.