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The B 35 Cluster with a Double-Hexagonal Vacancy: A New and More Flexible Structural Motif for Borophene

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What this work says

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

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Hepta‐ and Octacoordinate Boron in Molecular Wheels of Eight‐ and Nine‐Atom Boron Clusters: Observation and Confirmation

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B 19 − : An Aromatic Wankel Motor

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Probing the Synthesis of Two‐Dimensional Boron by First‐Principles Computations

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Comprehensive analysis of chemical bonding in boron clusters

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Polymorphism of Two-Dimensional Boron

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Electronic structures of boron nanoribbons

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New boron based nanostructured materials

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inferredcites →https://doi.org/10.1063/1.4824156openalex-snapshot

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inferredcites →https://doi.org/10.1063/1.4827501openalex-snapshot

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inferredcites →https://doi.org/10.1103/physrevb.77.041402openalex-snapshot

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inferredcites →https://doi.org/10.1103/physrevb.82.115412openalex-snapshot

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inferredcites →https://doi.org/10.1103/physrevlett.95.055501openalex-snapshot

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inferredcites →https://doi.org/10.1126/science.1079879openalex-snapshot

Au 20 : A Tetrahedral Cluster

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B7Se2− as a counterexample to terminal BSe multiple-bond dominance: competition between delocalized B7 bonding and terminal BSe multiple bonds

inferred← citeshttps://doi.org/10.1016/j.cplett.2016.01.052openalex-snapshot

Geometries, stabilities, and electronic properties of tungsten encapsulated nanosize irregular B (n= 20, 24, 28, and 32) fullerenes: A density functional investigation

inferred← citeshttps://doi.org/10.1016/j.cplett.2016.01.074openalex-snapshot

Novel α- and β-type boron sheets: Theoretical insight into their structures, thermodynamic stability, and work functions

inferred← citeshttps://doi.org/10.1016/j.cplett.2016.12.051openalex-snapshot

B26−: The smallest planar boron cluster with a hexagonal vacancy and a complicated potential landscape

inferred← citeshttps://doi.org/10.1016/j.cplett.2020.137701openalex-snapshot

An ab initio study of the B 35 boron nanocluster for application as atmospheric gas ( NO , NO 2 , N 2 O , NH 3 ) sensor

inferred← citeshttps://doi.org/10.1016/j.cplett.2022.139552openalex-snapshot

Novel heteroborospherene as drug delivery systems for favipiravir drug: Ab-initio study

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Application of two-dimensional materials as anodes for rechargeable metal-ion batteries: A comprehensive perspective from density functional theory simulations

inferred← citeshttps://doi.org/10.1016/j.flatc.2017.08.008openalex-snapshot

Structure and stability of bilayer borophene: The roles of hexagonal holes and interlayer bonding

inferred← citeshttps://doi.org/10.1016/j.flatc.2024.100799openalex-snapshot

Hydrogen binding on the B36 borophene nanoflake decorated with first row transition metal atoms: DFT, QTAIM and AIMD study

inferred← citeshttps://doi.org/10.1016/j.heliyon.2023.e17886openalex-snapshot

A DFT study to investigate the physical, electrical, optical properties and thermodynamic functions of boron nanoclusters (MxB2n0; x=1,2, n=3,4,5)

inferred← citeshttps://doi.org/10.1016/j.ijhydene.2021.11.157openalex-snapshot

Screening of transition metal single atom catalysts supported on B36 cluster for nitrogen fixation

inferred← citeshttps://doi.org/10.1016/j.inoche.2026.117259openalex-snapshot

Alkaline-earth metal doped umbrella-shaped boronyl clusters B9MO− (M = Be, Mg)

inferred← citeshttps://doi.org/10.1016/j.jechem.2023.11.031openalex-snapshot

MXenes: Versatile 2D materials with tailored surface chemistry and diverse applications

inferred← citeshttps://doi.org/10.1016/j.jphotochem.2023.114667openalex-snapshot

First theoretical framework of superalkali metals [M3X(M = Li, Na, k; X = O, S, F, N)] doped all-boron B38 nanocluster: A promising class of nonlinear optical materials for optoelectronic applications

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An insight into the structures, stabilities and magnetic properties of Fe2Bn (n = 1–10) clusters

inferred← citeshttps://doi.org/10.1016/j.matchemphys.2020.124104openalex-snapshot

Quasi-planar B50 sheet as a potential molecular sensor for NO2: A DFT study

inferred← citeshttps://doi.org/10.1016/j.mattod.2025.03.028openalex-snapshot

On the 10th anniversary of borophene: Birth, growth and status quo

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DNA sequencing by borophene nanosheet via an electronic response: A theoretical study

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An analysis of magnetic and hysteresis characteristics of a mixed spin Ising-type borophene monolayer

inferred← citeshttps://doi.org/10.1016/j.molliq.2021.116764openalex-snapshot

A density functional investigation on the structures, electronic, spectral and fluxional properties of VB20- cluster

inferred← citeshttps://doi.org/10.1016/j.molstruc.2022.132566openalex-snapshot

Study on structures, electronic, spectral and thermodynamic properties of lanthanide-doped boron-based MBn−(M=La, Ce, Pr; n=8, 9) clusters

inferred← citeshttps://doi.org/10.1016/j.molstruc.2024.140084openalex-snapshot

Chemical bonding and dynamic structural fluxionality of a boron-based MgAlB8+ nanocompass cluster

inferred← citeshttps://doi.org/10.1016/j.mtcomm.2019.100712openalex-snapshot

Selective capture of CO2 over N2 and CH4: B clusters and their size effects

inferred← citeshttps://doi.org/10.1016/j.mtcomm.2024.109778openalex-snapshot

Adsorption configuration, electronic structure and spectra of the harmful NH3, NO, and NO2 molecules on a bilayer boron cluster

inferred← citeshttps://doi.org/10.1016/j.mtener.2018.09.005openalex-snapshot

Two-dimensional quantum dots: Fundamentals, photoluminescence mechanism and their energy and environmental applications

inferred← citeshttps://doi.org/10.1016/j.nanoen.2016.03.013openalex-snapshot

Borophene: A promising anode material offering high specific capacity and high rate capability for lithium-ion batteries

inferred← citeshttps://doi.org/10.1016/j.physb.2019.05.002openalex-snapshot

Magnetic and thermal properties of a core-shell borophene structure: Monte Carlo study

inferred← citeshttps://doi.org/10.1016/j.physb.2022.414628openalex-snapshot

Probing the structural evolution and stabilities of CsB0/− (n = 2–12) clusters

inferred← citeshttps://doi.org/10.1016/j.physe.2017.02.018openalex-snapshot

Li interactions with the B 40 fullerene and its application in Li-ion batteries: DFT studies

inferred← citeshttps://doi.org/10.1016/j.physe.2019.113852openalex-snapshot

A new type of heteroborospherene as a versatile carrier for drug delivery: A theoretical study

inferred← citeshttps://doi.org/10.1016/j.physe.2020.114242openalex-snapshot

Exploring the adsorption and sensing behavior of the M-Nx-B36-x (M=Fe, Ni, and Cu; x=0, 3) bowl-shaped structures upon CO, NO, O2, and N2 molecules: A first-principles study

inferred← citeshttps://doi.org/10.1016/j.physe.2022.115364openalex-snapshot

A first principle study on sensing properties of quasi-planer born (B36 borophene) towards COS, SO2, H2S and CS2 gases

inferred← citeshttps://doi.org/10.1016/j.physleta.2016.06.016openalex-snapshot

B 36 borophene as an electronic sensor for formaldehyde: Quantum chemical analysis

inferred← citeshttps://doi.org/10.1016/j.physleta.2024.129979openalex-snapshot

Decoding the structural and electronic variations in M2Bn- (M = Sc, Y, La; n = 6–9) clusters: Insights for nanomaterial design

inferred← citeshttps://doi.org/10.1016/j.physleta.2025.130694openalex-snapshot

Theoretical study on the geometric structure and electronic properties of doped clusters Si2Bn (n = 1-12)

inferred← citeshttps://doi.org/10.1016/j.physleta.2025.131179openalex-snapshot

Geometric structures and electronic properties of neutral platinum-doped boron clusters

inferred← citeshttps://doi.org/10.1016/j.progsolidstchem.2020.100283openalex-snapshot

Synthesis, properties and novel electrocatalytic applications of the 2D-borophene Xenes

inferred← citeshttps://doi.org/10.1016/j.progsurf.2023.100704openalex-snapshot

Epitaxial growth of borophene on substrates

inferred← citeshttps://doi.org/10.1016/j.rechem.2026.103052openalex-snapshot

Chemical bonding and structural fluxionality of a boron-based B8Ca3 cluster

inferred← citeshttps://doi.org/10.1016/j.rinp.2019.102841openalex-snapshot

Evolution of amorphous boron transformed into crystal nanospheres under electron beam irradiation

inferred← citeshttps://doi.org/10.1016/j.rinp.2022.105214openalex-snapshot

Expanded spherical trihedral metallo-borospherenes of transition-metal doped boron clusters: TM3B15q (TM = Zr, Hf; q = −1, 0, +1)

inferred← citeshttps://doi.org/10.1016/j.rinp.2023.106223openalex-snapshot

Structural evolution and electronic properties of doped boron clusters Ta2B (n = 10 ∼ 20): Ta2B16 and Ta2B18 with strong aromaticity

inferred← citeshttps://doi.org/10.1016/j.rinp.2023.106583openalex-snapshot

Current, photocurrent and thermocurrent of borophene-black phosphorus heterostructures

inferred← citeshttps://doi.org/10.1016/j.scib.2018.02.006openalex-snapshot

Experimental realization of honeycomb borophene

inferred← citeshttps://doi.org/10.1016/j.solidstatesciences.2023.107248openalex-snapshot

On the structures and bonding of copper boride nanoclusters, Cu2Bx– (x = 5–7)

inferred← citeshttps://doi.org/10.1016/j.solidstatesciences.2025.107833openalex-snapshot

All-boron planar clusters with electric dipole moment

inferred← citeshttps://doi.org/10.1021/acs.accounts.5c00852openalex-snapshot

Manifestations of Boron-Alkali Metal and Boron-Alkaline-Earth Metal Romances

inferred← citeshttps://doi.org/10.1021/acs.chemrev.1c00165openalex-snapshot

Chemistry, Functionalization, and Applications of Recent Monoelemental Two-Dimensional Materials and Their Heterostructures

inferred← citeshttps://doi.org/10.1021/acs.chemrev.7b00524openalex-snapshot

Super Atomic Clusters: Design Rules and Potential for Building Blocks of Materials

inferred← citeshttps://doi.org/10.1021/acs.inorgchem.2c00494openalex-snapshot

Structure and Chemical Bonding in Medium-Size Boron Clusters Doped with Praseodymium

inferred← citeshttps://doi.org/10.1021/acs.inorgchem.2c00624openalex-snapshot

Large B 7 Triangles in Hollow Spherical Trihedral Metallo-borospherenes and Their Endohedral Complexes of B 20 TM n (TM = Sc, Y; n = 3, 4): a Theoretical Characterization

inferred← citeshttps://doi.org/10.1021/acs.inorgchem.3c04636openalex-snapshot

inferred← citeshttps://doi.org/10.1021/acs.inorgchem.7b02585openalex-snapshot

Structural Stability and Evolution of Medium-Sized Tantalum-Doped Boron Clusters: A Half-Sandwich-Structured TaB12 – Cluster

inferred← citeshttps://doi.org/10.1021/acs.jpca.1c01149openalex-snapshot

Expanded Inverse-Sandwich Complexes of Lanthanum Borides: La2B10– and La2B11–

inferred← citeshttps://doi.org/10.1021/acs.jpca.1c02764openalex-snapshot

Concentric Inner 2π/6σ and Outer 10π/14σ Aromaticity Underlies the Dynamic Structural Fluxionality of Planar B19– Wankel Motor Cluster

inferred← citeshttps://doi.org/10.1021/acs.jpca.1c08631openalex-snapshot

Ground and Electronically Excited States of Main-Group-Metal-Doped B20 Double Rings

inferred← citeshttps://doi.org/10.1021/acs.jpca.3c04270openalex-snapshot

Metalloborospherenes with a Stabilized Classical Fullerene-like Borospherene B 40 Act as Nonlinear Optical Switches, Electron Reservoirs, Molecular Capacitors, and Molecular Reactors

inferred← citeshttps://doi.org/10.1021/acs.jpca.4c00907openalex-snapshot

Probing the Structural and Electronic Properties of the Anionic and Neutral Tellurium-Doped Boron Clusters TeB n q ( n = 3–16, q = 0, −1)

inferred← citeshttps://doi.org/10.1021/acs.jpca.4c01282openalex-snapshot

Electronic Control of the Position of the Pb Atom on the Surface of B8 Borozene in the PbB8 Cluster

inferred← citeshttps://doi.org/10.1021/acs.jpca.4c07750openalex-snapshot

Pentagonal Star-like Three-Layered Aromatic Sandwich Structure of the [Li10Be2B5]+/0/– Cluster

inferred← citeshttps://doi.org/10.1021/acs.jpca.5c01459openalex-snapshot

Double Aromaticity and Inverse-Sandwich Structures in Double-Lanthanide-Doped Boron Clusters: Excitation from f-Electrons to d-Electrons

inferred← citeshttps://doi.org/10.1021/acs.jpca.6c00814openalex-snapshot

Orbital Localization-Driven Disruption of Peripheral Bonding in Valence-Isoelectronic B 12 – Clusters

inferred← citeshttps://doi.org/10.1021/acs.jpca.7b06123openalex-snapshot

Structure and Electronic Properties of Neutral and Negatively Charged RhB n Clusters ( n = 3–10): A Density Functional Theory Study

inferred← citeshttps://doi.org/10.1021/acs.jpca.7b12479openalex-snapshot

Planar Tricyclic B8O8 and B8O8– Clusters: Boron Oxide Analogues of s-Indacene C12H8

inferred← citeshttps://doi.org/10.1021/acs.jpca.8b02713openalex-snapshot

Boron Teetotum: Metallic [Ti(B6CxNy)]q and Bimetallic [Ti2(B6CxNy)]q Nine-Membered Heterocycles with x + y = 3 and −1 ≤ q ≤ 3

inferred← citeshttps://doi.org/10.1021/acs.jpca.9b03942openalex-snapshot

inferred← citeshttps://doi.org/10.1021/acs.jpcc.3c07613openalex-snapshot

First-Principles Study of Adsorption of Actinide Complexes on Borophene

inferred← citeshttps://doi.org/10.1021/acs.jpcc.6b10958openalex-snapshot

Probing the Structures of Neutral B11 and B12 Using High-Resolution Photoelectron Imaging of B11– and B12–

inferred← citeshttps://doi.org/10.1021/acs.jpcc.7b03359openalex-snapshot

A Practical Criterion for Screening Stable Boron Nanostructures

inferred← citeshttps://doi.org/10.1021/acs.jpcc.8b03811openalex-snapshot

Adsorption of the Gas Molecules NH 3 , NO, NO 2 , and CO on Borophene

inferred← citeshttps://doi.org/10.1021/acs.jpcc.9b10140openalex-snapshot

Electronic Structure and Properties of Silicon-Doped Boron Clusters BnSi withn= 15–24 and Their Anions

inferred← citeshttps://doi.org/10.1021/acs.jpcc.9b11426openalex-snapshot

Honeycomb Borophene Fragment Stabilized in Polyanionic Sandwich Lithium Salt: A New Type of Two-Dimensional Material with Superconductivity

inferred← citeshttps://doi.org/10.1021/acs.jpclett.4c00566openalex-snapshot

B 63 : The Most Stable Bilayer Structure with Dual Aromaticity

inferred← citeshttps://doi.org/10.1021/acs.jpclett.4c03294openalex-snapshot

Unravelling the Mechanical and Superconducting Properties in Borophene with Multicentered Bonds

inferred← citeshttps://doi.org/10.1021/acs.nanolett.6b03349openalex-snapshot

Substrate-Induced Nanoscale Undulations of Borophene on Silver

inferred← citeshttps://doi.org/10.1021/acs.nanolett.9b04798openalex-snapshot

Borophene Concentric Superlattices via Self-Assembly of Twin Boundaries

inferred← citeshttps://doi.org/10.1021/acsami.5b09949openalex-snapshot

Lithium–Boron (Li–B) Monolayers: First-Principles Cluster Expansion and Possible Two-Dimensional Superconductivity

inferred← citeshttps://doi.org/10.1021/acsami.5c19994openalex-snapshot

Thirty Years of Borophene: Origins, Scientific Progress, and Future Directions

inferred← citeshttps://doi.org/10.1021/acsami.9b19648openalex-snapshot

Crystalline Semiconductor Boron Quantum Dots

inferred← citeshttps://doi.org/10.1021/acsanm.1c01988openalex-snapshot

Mixed Dimensional Te Nanowire–Te Nanosheet Heterojunctions with 2D Electron Gas on SrTiO3 for Diode Applications

inferred← citeshttps://doi.org/10.1021/acscatal.6b00021openalex-snapshot

Mechanistic Insights into Propene Epoxidation with O2–H2O Mixture on Au7/α-Al2O3: A Hydroproxyl Pathway from ab Initio Molecular Dynamics Simulations

inferred← citeshttps://doi.org/10.1021/acsnano.3c03055openalex-snapshot

Nanoscopic Characterization Reveals that Bulk Amorphous Elementary Boron Is Composed of a Ladder-like Polymer with B4 as the Structural Unit

inferred← citeshttps://doi.org/10.1021/acsomega.0c02693openalex-snapshot

Structures, Electronic, and Spectral Properties of Doped Boron Clusters MB120/– (M = Li, Na, and K)

inferred← citeshttps://doi.org/10.1021/acsomega.0c05542openalex-snapshot

Structures and Properties of CoB19+/0/– Clusters

inferred← citeshttps://doi.org/10.1021/acsomega.5c09848openalex-snapshot

Structures and Chemical Bonding of B 5 O 7 +/0/– with a Hexagonal B 3 O 3 Ring†

inferred← citeshttps://doi.org/10.1021/acsomega.6c04129openalex-snapshot

Dual-Scandium-Capped Boron Cage: Structural and Electronic Properties of B 10 Sc 2

inferred← citeshttps://doi.org/10.1021/acsomega.6c06109openalex-snapshot

Mixed Localized and Delocalized Bonding in a Linear-B3-Centered B3Mg6– Cluster

inferred← citeshttps://doi.org/10.1021/acsomega.9b00209openalex-snapshot

Structures, Stabilities, and Spectral Properties of Endohedral Borospherenes M@B400/– (M = H2, HF, and H2O)

inferred← citeshttps://doi.org/10.1021/ja513209copenalex-snapshot

Two-Dimensional Cu 2 Si Monolayer with Planar Hexacoordinate Copper and Silicon Bonding

inferred← citeshttps://doi.org/10.1021/jacs.4c10728openalex-snapshot

Dative Bonding Activation Enables Precise Functionalization of the Remote B–H Bond of nido-Carborane Clusters

inferred← citeshttps://doi.org/10.1021/jacs.7b08680openalex-snapshot

Two-Dimensional Semiconducting Boron Monolayers

inferred← citeshttps://doi.org/10.1021/nn506262copenalex-snapshot

Experimental and Theoretical Evidence of an Axially Chiral Borospherene

inferred← citeshttps://doi.org/10.1038/ncomms9654openalex-snapshot

Cobalt-centred boron molecular drums with the highest coordination number in the CoB16− cluster

inferred← citeshttps://doi.org/10.1038/s41467-023-37442-8openalex-snapshot

Theory of sigma bond resonance in flat boron materials

inferred← citeshttps://doi.org/10.1038/s41570-017-0071openalex-snapshot

From planar boron clusters to borophenes and metalloborophenes

inferred← citeshttps://doi.org/10.1038/s41598-017-06039-9openalex-snapshot

Heteroborospherene clusters Nin ∈ B40 (n = 1–4) and heteroborophene monolayers Ni2 ∈ B14 with planar heptacoordinate transition-metal centers in η7-B7 heptagons

inferred← citeshttps://doi.org/10.1038/s41699-017-0018-2openalex-snapshot

Superior lattice thermal conductance of single-layer borophene

inferred← citeshttps://doi.org/10.1038/s43246-021-00184-5openalex-snapshot

Chemical stability of hydrogen boride nanosheets in water

inferred← citeshttps://doi.org/10.1038/srep17738openalex-snapshot

Three-Dimensional Assignment of the Structures of Atomic Clusters: an Example of Au8M (M=Si, Ge, Sn) Anion Clusters

inferred← citeshttps://doi.org/10.1038/srep25020openalex-snapshot

Comparative study on the spectral properties of boron clusters Bn0/−1(n = 38–40)

inferred← citeshttps://doi.org/10.1038/srep37893openalex-snapshot

From Quasi-Planar B56 to Penta-Ring Tubular Ca©B56: Prediction of Metal-Stabilized Ca©B56 as the Embryo of Metal-Doped Boron α-Nanotubes

inferred← citeshttps://doi.org/10.1038/srep40081openalex-snapshot

Structures, stabilities and spectral properties of borospherene B44− and metalloborospherenes MB440/− (M = Li, Na, and K)

inferred← citeshttps://doi.org/10.1038/srep45516openalex-snapshot

Molecular dynamics simulations for mechanical properties of borophene: parameterization of valence force field model and Stillinger-Weber potential

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