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Structure Determination of the 4d Metal Diborides: A Quantum Mechanical Study

https://doi.org/10.1021/jp056652x
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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1016/0022-5088(79)90142-5openalex-snapshot
Electron transfer and bonding in the transition metal diborides the heats of formation of the metal diborides derived from a theoretical bonding model
inferredcites →https://doi.org/10.1021/cm00015a035openalex-snapshot
Transition-metal borides with the tantalum boride (Ta3B4) crystal structure: their electronic and bonding properties
inferredcites →https://doi.org/10.1021/ja00281a020openalex-snapshot
Electronic structure of transition-metal borides with the AlB2 structure
inferredcites →https://doi.org/10.1038/167362a0openalex-snapshot
Borides and Silicides of the Platinum Metals
inferredcites →https://doi.org/10.1038/35065039openalex-snapshot
Superconductivity at 39 K in magnesium diboride
inferredcites →https://doi.org/10.1038/nature00898openalex-snapshot
The origin of the anomalous superconducting properties of MgB2
inferredcites →https://doi.org/10.1088/0953-8984/6/46/034openalex-snapshot
The electronic structure and chemical stability of the AlB2-type transition-metal diborides
inferredcites →https://doi.org/10.1103/physrevb.13.5188openalex-snapshot
Special points for Brillouin-zone integrations
inferredcites →https://doi.org/10.1103/physrevb.40.12255openalex-snapshot
Solution of Schrödinger’s equation for large systems
inferredcites →https://doi.org/10.1103/physrevb.45.13244openalex-snapshot
Accurate and simple analytic representation of the electron-gas correlation energy
inferredcites →https://doi.org/10.1103/physrevb.46.6671openalex-snapshot
Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation
inferredcites →https://doi.org/10.1103/physrevb.48.4978.2openalex-snapshot
Erratum: Atoms, molecules, solids, and surfaces: Applications of the generalized gradient approximation for exchange and correlation
inferredcites →https://doi.org/10.1103/physrevb.54.16317openalex-snapshot
Population analysis of plane-wave electronic structure calculations of bulk materials
inferredcites →https://doi.org/10.1103/physrevb.63.045115openalex-snapshot
Electronic structure, bonding, and ground-state properties of AlB_{2}-type transition-metal diborides
inferredcites →https://doi.org/10.1103/physrevb.64.020502openalex-snapshot
Electronic structure of superconducting MgB2 and related binary and ternary borides

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

inferred← citeshttps://doi.org/10.2139/ssrn.4678828openalex-extracted
Pressure-Induced Evolution of Structures and Phase Transition Of Technetium Diboride
inferred← citeshttps://doi.org/10.1002/pssr.201308086openalex-snapshot
Deformation‐induced bonding evolution of iron tetraboride and its electronic origin
inferred← citeshttps://doi.org/10.1007/s00339-023-06465-9openalex-snapshot
Phase stability, mechanical properties and thermal conductivity of technetium diborides in different crystal structures
inferred← citeshttps://doi.org/10.1016/j.actamat.2025.121413openalex-snapshot
Unprecedented B solubility in cubic (Hf,Ta,Ti,V,Zr)B-C-N coatings
inferred← citeshttps://doi.org/10.1016/j.commatsci.2011.08.033openalex-snapshot
Origin of the rigidity in tetragonal MB (M=Cr, Mo and W) and softening of defective WB: First-principles investigations
inferred← citeshttps://doi.org/10.1016/j.diamond.2016.03.017openalex-snapshot
First principle study of the attachment of graphene onto non-doped and doped diamond (111)
inferred← citeshttps://doi.org/10.1016/j.jallcom.2025.185222openalex-snapshot
Theoretical and experimental mechanical properties and thermal conductivity of W-Al-B thin films deposited by magnetron sputtering
inferred← citeshttps://doi.org/10.1016/j.physleta.2016.11.001openalex-snapshot
New ultra-incompressible phases of NbB4 predicted from first principles
inferred← citeshttps://doi.org/10.1016/j.ssc.2010.09.021openalex-snapshot
Elastic and electronic properties of low compressible 4d transition metal diborides: First principles calculations
inferred← citeshttps://doi.org/10.1016/j.vacuum.2021.110567openalex-snapshot
Review of transition-metal diboride thin films
inferred← citeshttps://doi.org/10.1021/acs.jpcc.5b07877openalex-snapshot
Influence of B Concentration on the Structural Stability and Mechanical Properties of Nb–B Compounds
inferred← citeshttps://doi.org/10.1021/acs.jpclett.9b00762openalex-snapshot
Predicting Novel 2D MB2 (M = Ti, Hf, V, Nb, Ta) Monolayers with Ultrafast Dirac Transport Channel and Electron-Orbital Controlled Negative Poisson’s Ratio
inferred← citeshttps://doi.org/10.1021/jp8091286openalex-snapshot
First-Principles Investigations of the Physical Properties of Magnesium Nitridoboride
inferred← citeshttps://doi.org/10.1039/c5cp04402bopenalex-snapshot
Phonon anomalies predict superconducting T c for AlB 2 -type structures
inferred← citeshttps://doi.org/10.1039/c6ra05162fopenalex-snapshot
Unexpected superhard phases of niobium triborides: first-principles calculations
inferred← citeshttps://doi.org/10.1039/d4cp00191eopenalex-snapshot
Discovery of superconductivity in technetium borides at moderate pressures
inferred← citeshttps://doi.org/10.1063/1.3692777openalex-snapshot
Unusual rigidity and ideal strength of CrB4 and MnB4
inferred← citeshttps://doi.org/10.1063/5.0207768openalex-snapshot
Pressure-induced evolution of structures and phase transition of technetium diboride
inferred← citeshttps://doi.org/10.1116/1.4948234openalex-snapshot
Synthesis and characterization of MoB2−x thin films grown by nonreactive DC magnetron sputtering
inferred← citeshttps://doi.org/10.1142/s0217984914502133openalex-snapshot
Structural determination and physical properties of 4d transitional metal diborides by first-principles calculations
inferred← citeshttps://doi.org/10.1155/2019/9098256openalex-snapshot
First Principle Study of the Attachment of Graphene onto Different Terminated Diamond (111) Surfaces
inferred← citeshttps://doi.org/10.3384/diss.diva-128614openalex-snapshot
ZrB2 Thin Films : Growth and Characterization
inferred← citeshttps://doi.org/10.3390/cryst5040562openalex-snapshot
Enthalpies of Formation of Transition Metal Diborides: A First Principles Study
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