BHC

This chemical notation refers to a specific boron-carbon-hydrogen compound. Such materials are typically investigated for their role in specialized chemical synthesis or as precursors in the development of advanced ceramic and electronic materials.

BCH
Overview

Key Properties

Cross-validated computational properties for BHC, aggregated across 3 databases.

Band Gap

0.18 eV
Range across DFT structures

Energy Above Hull

0.828 eV/atom
Best (lowest) across sources

Stability

Above hull
2 DFT sources

Structures

16
3 databases, 9 space groups
Crystallography

Reported Structures

Lowest-energy structures reported for BHC, ranked by energy above hull.

Space GroupCrystal SystemBand Gap (eV)E above hull (eV/atom)E/atom (eV)Density (g/cm³)
P-1 (No. 2)triclinic0.180.8279-6.1630.81
Pmm2 (No. 25)
P-6m2 (No. 187)
P63/mmc (No. 194)
Amm2 (No. 38)Orthorhombic1.87
P-3m1 (No. 164)Trigonal2.60
P-3m1 (No. 164)Trigonal2.23
P-3m1 (No. 164)Trigonal2.18
P21/m (No. 11)Monoclinic2.19
Amm2 (No. 38)Orthorhombic2.22
Cm (No. 8)Monoclinic2.53
Cmmm (No. 65)Orthorhombic2.77
Uses

Applications

Where BHC is used.

Chemical synthesisMaterials science research
Reference

Frequently Asked Questions

Common questions about BHC, answered from cross-validated data.

What is BHC?

This chemical notation refers to a specific boron-carbon-hydrogen compound. Such materials are typically investigated for their role in specialized chemical synthesis or as precursors in the development of advanced ceramic and electronic materials.

More questions
What is BHC used for?
BHC is used in chemical synthesis and materials science research.
What is the band gap of BHC?
BHC has a DFT-computed band gap of 0.18 eV across 16 reported structures.
Is BHC a metal, semiconductor, or insulator?
With a band gap up to 0.18 eV it is a semiconductor.
Is BHC thermodynamically stable?
BHC has a lowest energy above hull of 0.828 eV/atom (above hull).
What is the crystal structure of BHC?
The lowest-energy reported polymorph of BHC is triclinic symmetry, space group P-1 (No. 2).
What is the density of BHC?
The computed density of the ground-state structure of BHC is 0.81 g/cm³.
How many polymorphs of BHC are known?
16 structures of BHC are reported across 3 databases, spanning 9 distinct space groups.
What elements does BHC contain?
BHC contains B, C, and H (3 elements).
Where does the data for BHC come from?
BHC data is cross-referenced from materials_project, jarvis, mpaloe.
Data sources & attribution
  • materials_project — Data from the Materials Project. Cite: Jain et al., APL Materials 1, 011002 (2013).
  • jarvis — Data from JARVIS (NIST). Cite: Choudhary et al., npj Comp. Mater. 6, 173 (2020).
  • mpaloe — Data from mpaloe.

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