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Search for "charge density" in Full Text gives 135 result(s) in Beilstein Journal of Nanotechnology.

Study of the reusability and stability of nylon nanofibres as an antibody immobilisation surface

  • Inés Peraile,
  • Matilde Gil-García,
  • Laura González-López,
  • Nushin A. Dabbagh-Escalante,
  • Juan C. Cabria-Ramos and
  • Paloma Lorenzo-Lozano

Beilstein J. Nanotechnol. 2024, 15, 83–94, doi:10.3762/bjnano.15.8

Graphical Abstract
  • an environment of high ion concentration capable of interacting with any charge density group, disrupting the hydrophobic bonds between protein A/G and antibody and the hydrogen bonds between protein A/G and nylon, as well as the bare nylon nanofibres. Results of stability study As this system is
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Published 15 Jan 2024

Berberine-loaded polylactic acid nanofiber scaffold as a drug delivery system: The relationship between chemical characteristics, drug-release behavior, and antibacterial efficiency

  • Le Thi Le,
  • Hue Thi Nguyen,
  • Liem Thanh Nguyen,
  • Huy Quang Tran and
  • Thuy Thi Thu Nguyen

Beilstein J. Nanotechnol. 2024, 15, 71–82, doi:10.3762/bjnano.15.7

Graphical Abstract
  • positively charged quaternary ammonium groups of BBR, increasing the charge density of the blend solution. As the higher charged solution jet, the elongation force imposed on the jet was higher, forming smaller fibers [3][34]. Interestingly, although the same amount of BBR drug was incorporated in the BBR
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Published 12 Jan 2024

Density functional theory study of Au-fcc/Ge and Au-hcp/Ge interfaces

  • Olga Sikora,
  • Małgorzata Sternik,
  • Benedykt R. Jany,
  • Franciszek Krok,
  • Przemysław Piekarz and
  • Andrzej M. Oleś

Beilstein J. Nanotechnol. 2023, 14, 1093–1105, doi:10.3762/bjnano.14.90

Graphical Abstract
  • provide surface energy details for gold and germanium crystals and the charge density differences for the Au/Ge heterostructures. Methodology Interfacial energy and the work of separation in DFT calculations In contrast to the bulk phase of a material, the surface atoms have an incomplete set of neighbors
  • Au atom (the difference arises from different number of unbound germanium electrons in a given crystal surface). Even deeper insight into the formation of these bonding states can be gained by investigating the charge density and charge redistribution at the interface. Figure 12a shows the charge
  • accumulation (yellow) and charge depletion (light blue) regions with respect to separate Ge and Au slabs terminated with vacuum (see Appendix B for details). One can observe charge accumulation between the interface Ge and Au atoms, as expected for bond formation. Figure 12b presents the charge density map for
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Published 15 Nov 2023

Isolation of cubic Si3P4 in the form of nanocrystals

  • Polina K. Nikiforova,
  • Sergei S. Bubenov,
  • Vadim B. Platonov,
  • Andrey S. Kumskov,
  • Nikolay N. Kononov,
  • Tatyana A. Kuznetsova and
  • Sergey G. Dorofeev

Beilstein J. Nanotechnol. 2023, 14, 971–979, doi:10.3762/bjnano.14.80

Graphical Abstract
  • , and for charge density at 240 Ry. IR spectra of Si NPs (a) upon etching and (b) before etching. XRD diffraction patterns of (a) Si, (b) SP900, (c) SP670, and (d) SP400. The asterisk denotes a peak from the copper admixture, as discussed in the main text. The vertical lines correspond to the
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Published 26 Sep 2023

Bismuth-based nanostructured photocatalysts for the remediation of antibiotics and organic dyes

  • Akeem Adeyemi Oladipo and
  • Faisal Suleiman Mustafa

Beilstein J. Nanotechnol. 2023, 14, 291–321, doi:10.3762/bjnano.14.26

Graphical Abstract
  • semiconductor and a noble metal with an appropriate work function. A unidirectional charge transfer is enabled by the Schottky potential barrier, increasing charge density and separation [72]. Shen et al. [166] created a Schottky junction by synthesising NiSe2 nanosheets on top of BiVO4 nanosheets using a
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Published 03 Mar 2023

Batch preparation of nanofibers containing nanoparticles by an electrospinning device with multiple air inlets

  • Dong Wei,
  • Chengwei Ye,
  • Adnan Ahmed and
  • Lan Xu

Beilstein J. Nanotechnol. 2023, 14, 141–150, doi:10.3762/bjnano.14.15

Graphical Abstract
  • shrink and bend as much as possible, and the change of external electric field would interact with the accumulated charges on the polymer fluid surface, making the charge density on the charged fluid surface uneven. Accordingly, the formulas to calculate these three forces are as follows: where ρ is the
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Published 23 Jan 2023

LED-light-activated photocatalytic performance of metal-free carbon-modified hexagonal boron nitride towards degradation of methylene blue and phenol

  • Nirmalendu S. Mishra and
  • Pichiah Saravanan

Beilstein J. Nanotechnol. 2022, 13, 1380–1392, doi:10.3762/bjnano.13.114

Graphical Abstract
  • also increased the availability of charge carriers in MBN-80 (Nd: 2.97 × 1019 cm−3) which was found to be significantly greater than that in HBN (Nd: 7.38 × 1018 cm−3). The increased charge density in MBN could be attributed to the accumulation of electrons over the carbon atom which aids in the
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Published 22 Nov 2022

Application of nanoarchitectonics in moist-electric generation

  • Jia-Cheng Feng and
  • Hong Xia

Beilstein J. Nanotechnol. 2022, 13, 1185–1200, doi:10.3762/bjnano.13.99

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  • 4.0. (b, c) Cross-sectional SEM images of a Ni–Al LDH film. Figure 4b and 4c were adapted from [52]. This article was published in Nano Energy, vol. 70, by J. Tian; Y. Zang; J. Sun; J. Qu; F. Gao; G. Liang, “Surface charge density-dependent performance of Ni–Al layered double hydroxide-based flexible
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Published 25 Oct 2022

Biomimetic chitosan with biocomposite nanomaterials for bone tissue repair and regeneration

  • Se-Kwon Kim,
  • Sesha Subramanian Murugan,
  • Pandurang Appana Dalavi,
  • Sebanti Gupta,
  • Sukumaran Anil,
  • Gi Hun Seong and
  • Jayachandran Venkatesan

Beilstein J. Nanotechnol. 2022, 13, 1051–1067, doi:10.3762/bjnano.13.92

Graphical Abstract
  • deacetylation in the chitosan, the positive charge density increases, which results in high electrostatic interaction which electrically stimulate the osteoblasts to proliferative and differentiate [46][47][48]. Chitosan biomaterials containing graphene oxides were used as substrates for the generation of
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Published 29 Sep 2022

Effects of focused electron beam irradiation parameters on direct nanostructure formation on Ag surfaces

  • Jānis Sniķeris,
  • Vjačeslavs Gerbreders,
  • Andrejs Bulanovs and
  • Ēriks Sļedevskis

Beilstein J. Nanotechnol. 2022, 13, 1004–1010, doi:10.3762/bjnano.13.87

Graphical Abstract
  • the irradiation process. If the electric field, which causes the movement of metal ions, was centred around the focus of the EB where the negative charge density is the highest, moving the focus above the surface would have increased the electric field component in a positive direction along the z
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Published 22 Sep 2022

Theoretical investigations of oxygen vacancy effects in nickel-doped zirconia from ab initio XANES spectroscopy at the oxygen K-edge

  • Dick Hartmann Douma,
  • Lodvert Tchibota Poaty,
  • Alessio Lamperti,
  • Stéphane Kenmoe,
  • Abdulrafiu Tunde Raji,
  • Alberto Debernardi and
  • Bernard M’Passi-Mabiala

Beilstein J. Nanotechnol. 2022, 13, 975–985, doi:10.3762/bjnano.13.85

Graphical Abstract
  • 2 × 2 × 2 Monkhorst–Pack grid, while convergence thresholds of 10−8 Ry and 10−3 Ry/Bohr have been adopted for the total energy and atomic forces, respectively. The plane wave basis set used to represent the Kohn–Sham (KS) orbitals has a kinetic energy of 50 Ry with 500 Ry as the charge density. The
  • is calculated as follows: First, the charge density is obtained through a self-consistent DFT calculation with 1s core hole on the absorbing oxygen atom, and the cross section is then calculated for a given polarization direction using the Lanczos method and the continued fraction [45]. This approach
  • does not require an explicit calculation of empty states and is very fast since only the charge density is needed [34]. Our supercell of size 2 × 2 × 2 (96 atoms) is sufficiently large to avoid the interaction between periodic images of the absorbing atom. In fact, a smaller supercell size of 72 atoms
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Published 15 Sep 2022

Modeling a multiple-chain emeraldine gas sensor for NH3 and NO2 detection

  • Hana Sustkova and
  • Jan Voves

Beilstein J. Nanotechnol. 2022, 13, 721–729, doi:10.3762/bjnano.13.64

Graphical Abstract
  • molecular properties of polyaniline have been studied by quantum mechanical means in [4][8]. The band structure was calculated by Reis et al. [9], together with transmittance, electrical current flow, and charge density. For these calculations, density functional theory (DFT, [10]) based on the generalized
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Published 26 Jul 2022

The effect of metal surface nanomorphology on the output performance of a TENG

  • Yiru Wang,
  • Xin Zhao,
  • Yang Liu and
  • Wenjun Zhou

Beilstein J. Nanotechnol. 2022, 13, 298–312, doi:10.3762/bjnano.13.25

Graphical Abstract
  • Normal University, Neijiang 641100, China 10.3762/bjnano.13.25 Abstract In this work, the effect of charge density and nanomorphology of a metal tip on the output performance of a triboelectric nanogenerator (TENG) is studied. The basic working principle of the TENG is charge transfer after separation
  • concentration, and temperature during the electrodeposition of copper. The samples were characterized using XRD and SEM. The output performance of the TENG is closely related to the size, charge density distribution, and shape of the metal nanoparticles. Keywords: charge density; green energy; metal
  • charge density [35][36][37], (2) reduction of the impact of the external environment on TENGs [38][39], (3) enhancement of the surface charge density, including active charge pumping and intercalation of a charge trap layer [40][41], and (4) increase of the number of TENG units [42][43]. In order to
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Published 15 Mar 2022

Plasma modes in capacitively coupled superconducting nanowires

  • Alex Latyshev,
  • Andrew G. Semenov and
  • Andrei D. Zaikin

Beilstein J. Nanotechnol. 2022, 13, 292–297, doi:10.3762/bjnano.13.24

Graphical Abstract
  • relation and are linked to the charge density and the phase operators and as Physically, represents the magnetic flux operator, while the operator is proportional to that for the total charge that has passed through the point x of the i-th wire up to the same time moment t, that is, As we already
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Published 04 Mar 2022

Engineered titania nanomaterials in advanced clinical applications

  • Padmavati Sahare,
  • Paulina Govea Alvarez,
  • Juan Manual Sanchez Yanez,
  • Gabriel Luna-Bárcenas,
  • Samik Chakraborty,
  • Sujay Paul and
  • Miriam Estevez

Beilstein J. Nanotechnol. 2022, 13, 201–218, doi:10.3762/bjnano.13.15

Graphical Abstract
  • found that nps smaller than 100 nm produce more ROS due to their higher surface area [29]. Properties of nps such as surface charge density and zeta potential are influential in determining their reactivity, agglomeration properties, interaction with cells, stability in complex media, and adsorption of
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Published 14 Feb 2022

Topographic signatures and manipulations of Fe atoms, CO molecules and NaCl islands on superconducting Pb(111)

  • Carl Drechsel,
  • Philipp D’Astolfo,
  • Jung-Ching Liu,
  • Thilo Glatzel,
  • Rémy Pawlak and
  • Ernst Meyer

Beilstein J. Nanotechnol. 2022, 13, 1–9, doi:10.3762/bjnano.13.1

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  • . Importantly, STM images on both substrates revealed local maxima between individual CO molecules constituting the chains like on Pb(110). These observations were suggested to be related to a charge density perturbation resulting from substrate-mediated attractive interaction between CO molecules. Note also
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Published 03 Jan 2022

Biocompatibility and cytotoxicity in vitro of surface-functionalized drug-loaded spinel ferrite nanoparticles

  • Sadaf Mushtaq,
  • Khuram Shahzad,
  • Tariq Saeed,
  • Anwar Ul-Hamid,
  • Bilal Haider Abbasi,
  • Nafees Ahmad,
  • Waqas Khalid,
  • Muhammad Atif,
  • Zulqurnain Ali and
  • Rashda Abbasi

Beilstein J. Nanotechnol. 2021, 12, 1339–1364, doi:10.3762/bjnano.12.99

Graphical Abstract
  • drug molecules and NPs were acid labile in nature, resulting in the detachment of the drug from NPs under acidic conditions (pH. 5.5) [32]. The drug release became slower and sustained after that. Acidic conditions change the surface charge density which causes deionization of amide bonds, resulting in
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Published 02 Dec 2021

A review on slip boundary conditions at the nanoscale: recent development and applications

  • Ruifei Wang,
  • Jin Chai,
  • Bobo Luo,
  • Xiong Liu,
  • Jianting Zhang,
  • Min Wu,
  • Mingdan Wei and
  • Zhuanyue Ma

Beilstein J. Nanotechnol. 2021, 12, 1237–1251, doi:10.3762/bjnano.12.91

Graphical Abstract
  • density on the distribution of the electrostatic potential within the EDL, many previous studies have investigated how the surface charge density can affect the solvent hydrodynamic slippage on solid surfaces. It was demonstrated by many researches that when the surface charge density increases, the slip
  • length correspondingly decreases [23][46]. Joly et al. proposed an approximate model to describe the relationship between the slip length and surface charge density. They validated the model by using a MD simulation with an ionized solution system represented by models of ideal solvents and ions [46
  • ]. Furthermore, Rezaei et al. performed MD simulations to study the electro-osmotic flow of an aqueous NaCl solution on a charged silicon surface [23], and similar conclusions as the ones proposed by Joly et al. were drawn in terms of the relationship between slip length and surface charge density. On the other
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Published 17 Nov 2021

First-principles study of the structural, optoelectronic and thermophysical properties of the π-SnSe for thermoelectric applications

  • Muhammad Atif Sattar,
  • Najwa Al Bouzieh,
  • Maamar Benkraouda and
  • Noureddine Amrane

Beilstein J. Nanotechnol. 2021, 12, 1101–1114, doi:10.3762/bjnano.12.82

Graphical Abstract
  • conductivity, which might occur through a few properties, such as a complex crystal lattice [14], large molecular mass [23], and charge density wave distortions [24]. In recent years, numerous thermoelectric alloys have shown an outstanding thermoelectric efficiency with ZT values greater than two by
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Published 05 Oct 2021

Uniform arrays of gold nanoelectrodes with tuneable recess depth

  • Elena O. Gordeeva,
  • Ilya V. Roslyakov,
  • Alexey P. Leontiev,
  • Alexey A. Klimenko and
  • Kirill S. Napolskii

Beilstein J. Nanotechnol. 2021, 12, 957–964, doi:10.3762/bjnano.12.72

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  • IV). The charge density, which passes before the metal nanowires reach the AAO surface (qexp), is strongly affected by Ed (Figure 2b). An increase in overpotential leads to a decrease in the average filling the AAO template with metal. According to Faraday’s law, the electric charge density required
  • with electrical contact, Cu was re-deposited on the surface of the Au segments (Figure 3a). The experiment was carried out at Ed = −0.1 V and limited by the electrical charge density, which is equal to the corresponding value in the case of electrodeposition of the first Cu segment. SEM images of the
  • constant voltage of 40 V. The temperature of the electrolyte was kept constant at 20 °C. The anodizing duration was controlled coulometrically using a thickness-to-charge density ratio of 500 nm·cm2·C−1 [39]. At the first stage, a sacrificial oxide layer with a thickness of 10 µm was formed and then
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Published 30 Aug 2021

Prediction of Co and Ru nanocluster morphology on 2D MoS2 from interaction energies

  • Cara-Lena Nies and
  • Michael Nolan

Beilstein J. Nanotechnol. 2021, 12, 704–724, doi:10.3762/bjnano.12.56

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  • site hollow, which has formed a Ru4S3 cluster has a Bader charge of 7.6 electrons for the atop Ru atom that forms new Ru–S bonds. Further details of the Bader charge analysis are given in section S1.3 of Supporting Information File 1. The changes in charge density are localised around the adatoms and
  • the Mo and S atoms in the immediate neighbourhood of the adatoms. Atoms that were found to be near metallic during the Bader analysis are also found to have somewhat less charge density compared to atoms that were oxidised. There is no distinct difference in how Co and Ru affect the charge density
  • with adsorption to MoS2. Examples of the charge density differences are shown in Figure S1 and Figure S2 of Supporting Information File 1, with some additional discussion in section S1.4. Analysis of DOS plots shows that the Mo d-orbital or the S p-orbital contributions are largely unaffected by adatom
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Published 14 Jul 2021

A review of defect engineering, ion implantation, and nanofabrication using the helium ion microscope

  • Frances I. Allen

Beilstein J. Nanotechnol. 2021, 12, 633–664, doi:10.3762/bjnano.12.52

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  • by localized helium ion irradiation. For example, using a helium ion dose of 5 × 1014 ions/cm2, permanent local tuning of the charge density in an amorphous thin film of the semiconductor indium gallium zinc oxide (film thickness 50 nm) has been demonstrated, thereby enabling activation of the
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Published 02 Jul 2021

Simulation of gas sensing with a triboelectric nanogenerator

  • Kaiqin Zhao,
  • Hua Gan,
  • Huan Li,
  • Ziyu Liu and
  • Zhiyuan Zhu

Beilstein J. Nanotechnol. 2021, 12, 507–516, doi:10.3762/bjnano.12.41

Graphical Abstract
  • area. Further, in order to eliminate the inevitable topological change during the actual movement of the TENG, an air gap was established in COMSOL to construct the two-dimensional model of the TENG. Based on the assumption that the surface charge density of the triboelectric nanogenerator is constant
  • materials approach or move away from each other, other substances, such as water vapor, carbon dioxide, and other gases, can pass through the gap. We present a simulation with water vapor under ideal conditions, that is, the surface charge density may be changed during the experiment. A simplified two
  • triboelectric materials is helpful for distinguishing different gases. It is noted that water or humidity can degrade the surface charge density of the electrification surfaces in an actual experiment. We will carry out further investigations in the future. Conclusion Simulations of three differently shaped
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Published 28 May 2021

Reconstruction of a 2D layer of KBr on Ir(111) and electromechanical alteration by graphene

  • Zhao Liu,
  • Antoine Hinaut,
  • Stefan Peeters,
  • Sebastian Scherb,
  • Ernst Meyer,
  • Maria Clelia Righi and
  • Thilo Glatzel

Beilstein J. Nanotechnol. 2021, 12, 432–439, doi:10.3762/bjnano.12.35

Graphical Abstract
  • function of this layer is reduced by −1.7 eV compared to Ir(111) as shown by KPFM and in accordance with charge density calculations. A single layer of graphene between KBr and Ir(111) weakens the strong KBr/Ir interaction and the KBr islands recover to the expected cubic lattice. The work function
  • computational suite [54][55]. The plane-wave expansion of the electronic wave function (charge density) was truncated using a 30 Ry (240 Ry) cutoff for the kinetic energy, as the pseudopotentials employed in this work were ultrasoft. We added a Gaussian smearing of 0.002 Rydberg to better describe the
  • ][45][46]. To evaluate these charges, Bader identifies the atomic volume as the spatial region delimited zero flux surfaces, that is, the two-dimensional surfaces where the charge density is a minimum perpendicular to the surface. The charge enclosed in the Bader volume can be considered the total
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Published 11 May 2021

Paper-based triboelectric nanogenerators and their applications: a review

  • Jing Han,
  • Nuo Xu,
  • Yuchen Liang,
  • Mei Ding,
  • Junyi Zhai,
  • Qijun Sun and
  • Zhong Lin Wang

Beilstein J. Nanotechnol. 2021, 12, 151–171, doi:10.3762/bjnano.12.12

Graphical Abstract
  • phenomenon. However, the results were highly controversial [88][89]. Xu et al. [90] have proposed that the quantification of the surface charge density at different temperature values is a critical method for investigating this phenomenon. This can be readily explored as an effective tool to identify the
  • electrode or into a charge-enriched friction layer to improve P-TENG output performances. As the TENG output performance closely depends on the triboelectric polarity of the friction layer, the engineering of friction layers with more charges with an opposite polarity induces a larger triboelectric charge
  • density. Since paper is mainly composed of cellulose, which generally shows a tendency of losing electrons (electropositive), it is preferred to pair paper with a friction material that can easily gain electrons (electronegative) according to the triboelectric series [83][99][100]. Figure 4 depicts a
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Published 01 Feb 2021
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