Nanoarchitectonics with cetrimonium bromide on metal nanoparticles for linker-free detection of toxic metal ions and catalytic degradation of 4-nitrophenol

• Akash Kumar and
• Raja Gopal Rayavarapu

Beilstein J. Nanotechnol. 2024, 15, 1312–1332, doi:10.3762/bjnano.15.106

• high strength to nanoparticles, the use of such nanoparticles is limited in sensing, catalysis, and biomedical applications because of post-synthesis functionalization, morphology, and toxicity [6][7][8]. CTAB is a resilient molecule on the nanoparticle surface because of its micellar structure and

• does not allow for interactions with ligands via ion–ion interactions. Therefore, multiple surface modifications or linkers must be used for selective interaction between ligand and CTAB-capped gold and silver nanoparticles [7][9]. Contaminants in form of heavy metals and pollutant such as 4

• -dependent impact of nanoparticle stability in NaOH was evaluated using gold nanorods (AuNRs) of two different lengths. AuNR10.5 (set 5), AuNR11.0 (set 6), AuNR20.5 (set 7), and AuNR21.0 (set 8) showed no plasmonic and colorimetric changes in the presence of NaOH (Figure 4c). The as-prepared AuNR20.5 and

Interaction of graphene oxide with tannic acid: computational modeling and toxicity mitigation in C. elegans

• Romana Petry,
• James M. de Almeida,
• Francine Côa,
• Felipe Crasto de Lima,
• Diego Stéfani T. Martinez and
• Adalberto Fazzio

Beilstein J. Nanotechnol. 2024, 15, 1297–1311, doi:10.3762/bjnano.15.105

• on larger scales [4]. Nowadays, there is an increasing commercial availability of graphene-related products and companies with large-scale production capabilities of these materials, which includes GO as an intermediate or final product [5][6][7]. Because of the growing industrial and technological

• each depth was recorded in the profiles shown in Figure 7, which were normalized regarding the maximum intensity found in the region. The intensity profiles and the respective spectra, were used to draw conclusions about GO’s internalization in the organisms. According to Figure 7, GO was found along

• fingerprint region with 1734(1), 1625(2), 1390(3), 1230(4), and 1068(5) cm−1 bands, and TA-related bands at 1704(6), 1600(7), 1310(8), and 1180(9) cm−1; b) Raman spectra normalized by intensity of G band; High-resolution C 1s XPS analysis of c) GO and d) GO with TA (10 mg·L−1) showing the peaks of carbon sp2

Mn-doped ZnO nanopowders prepared by sol–gel and microwave-assisted sol–gel methods and their photocatalytic properties

• Cristina Maria Vlăduț,
• Crina Anastasescu,
• Silviu Preda,
• Oana Catalina Mocioiu,
• Simona Petrescu,
• Jeanina Pandele-Cusu,
• Dana Culita,
• Veronica Bratan,
• Ioan Balint and
• Maria Zaharescu

Beilstein J. Nanotechnol. 2024, 15, 1283–1296, doi:10.3762/bjnano.15.104

• distribution of the resulting nanomaterials [7][8][9]. Recently, the use of microwave energy for synthesizing functional nanomaterials has garnered significant interest [10][11]. The microwave-assisted sol–gel technique (MW) has been reported to be simpler, faster, more cost-effective, and more energy

• explained by the influence of the microwave irradiation, which is known to create materials with fewer defects [49]. Porosimetry The nitrogen adsorption–desorption isotherms and pore size distributions are presented in Figure 7. The adsorption and desorption branches for both samples appear to be almost

• parallel in Figure 7. The insets show a wide pore size distribution reaching 120 nm and pore width maxima located in the mesoporosity area for both samples (40 nm for SG and 35–45 nm for MW). Similar textural features for SG and MW samples are presented in Table 3. UV–vis spectroscopy The recorded UV–vis

New design of operational MEMS bridges for measurements of properties of FEBID-based nanostructures

• Bartosz Pruchnik,
• Krzysztof Kwoka,
• Ewelina Gacka,
• Dominik Badura,
• Piotr Kunicki,
• Andrzej Sierakowski,
• Paweł Janus,
• Tomasz Piasecki and
• Teodor Gotszalk

Beilstein J. Nanotechnol. 2024, 15, 1273–1282, doi:10.3762/bjnano.15.103

• emission occur [3][4][5]. There are only a few processes with resolution and repeatability suitable for creating nanostructures, and even fewer are available for self-standing nanostructures. That includes epitaxial techniques as well as focused electron beam-induced deposition (FEBID) [6][7]. Integration

• , 17 pA, 13 ms dwell time, a single line pattern in a single pass with 4 nm pitch, and MeCpPtMe3 precursor at 321 K with a flow rate of 8.5 × 10−4 μm3/s. The pattern line was set to begin on one electrode and end on the other (Figure 7). In between, the nanowire growth proceeded horizontally with an

Functional morphology of cleaning devices in the damselfly Ischnura elegans (Odonata, Coenagrionidae)

• Silvana Piersanti,
• Gianandrea Salerno,
• Wencke Krings,
• Stanislav Gorb and
• Manuela Rebora

Beilstein J. Nanotechnol. 2024, 15, 1260–1272, doi:10.3762/bjnano.15.102

• inorganic and organic particles, which can disrupt its normal function or hinder essential physiological processes, ultimately decreasing survival rates. As a result, insects dedicate a considerable amount of time to self-grooming to eliminate debris [6][7], parasites [8], and pathogens [9]. This grooming

The role of a tantalum interlayer in enhancing the properties of Fe₃O₄ thin films

• Hai Dang Ngo,
• Vo Doan Thanh Truong,
• Van Qui Le,
• Hoai Phuong Pham and
• Thi Kim Hang Pham

Beilstein J. Nanotechnol. 2024, 15, 1253–1259, doi:10.3762/bjnano.15.101

• study of analog resistive switching of Fe3O4-based cross-cell memristive devices [7][8][9][10]. Fe3O4 thin films can be grown by many processes, including molecular beam epitaxy, which is employed for depositing single crystal films, and pulsed laser deposition, which is utilized to achieve epitaxial

Dual-functionalized architecture enables stable and tumor cell-specific SiO₂NPs in complex biological fluids

• Iris Renata Sousa Ribeiro,
• Raquel Frenedoso da Silva,
• Romênia Ramos Domingues,
• Adriana Franco Paes Leme and
• Mateus Borba Cardoso

Beilstein J. Nanotechnol. 2024, 15, 1238–1252, doi:10.3762/bjnano.15.100

• [1][2][3][4]. Consequently, the scientific community has focused on improving the targeting of nanoparticles (NPs) to tumor cells through surface functionalization with active groups (e.g., folate, monoclonal antibodies) [5][6][7]. However, according to the literature, only 0.7% of the injected dose

• ), SiO2NPs-ZW-NH2 (with ZW + APTES), and SiO2NPs-ZW-FO (with ZW + APTES + folate). Characterization of SiO2NPs Scanning electron microscopy (SEM) micrographs were obtained in a high-resolution FEI Inspect F50 microscope. A NP suspension (7 μL) was deposited directly onto a copper substrate, dried, and

Enhanced catalytic reduction through in situ synthesized gold nanoparticles embedded in glucosamine/alginate nanocomposites

• Chi-Hien Dang,
• Le-Kim-Thuy Nguyen,
• Minh-Trong Tran,
• Van-Dung Le,
• Nguyen Minh Ty,
• T. Ngoc Han Pham,
• Hieu Vu-Quang,
• Tran Thi Kim Chi,
• Tran Thi Huong Giang,
• Nguyen Thi Thanh Tu and
• Thanh-Danh Nguyen

Beilstein J. Nanotechnol. 2024, 15, 1227–1237, doi:10.3762/bjnano.15.99

• environment and biological systems. Consequently, integrating green chemistry principles into nanotechnology has become a focus of nanoscience research [6][7]. Numerous studies have highlighted the use of natural compounds or natural sources in the green synthesis of AuNPs [8][9]. Polysaccharides, in

• parameters, the synthesis of AuNPs@GluN/Alg was fine-tuned to determine the optimal conditions. The impact of the mass ratio between metallic ions and GluN/Alg gel was investigated at levels of 1%, 3%, 5%, 7%, and 9% (w/w). The reaction temperature ranged from 30 to 90 °C, while the reaction time varied from

• homogeneous nanoparticles, we opted for an Au3+-to-gel ratio of 7% for further investigations. Figure 2C,D illustrates the significant impact of the reaction temperature on the formation of nanocomposites. As the temperature increases, the UV–vis absorbance rises, reaching a peak at 70 °C, after which the

Realizing active targeting in cancer nanomedicine with ultrasmall nanoparticles

• André F. Lima,
• Giselle Z. Justo and
• Alioscka A. Sousa

Beilstein J. Nanotechnol. 2024, 15, 1208–1226, doi:10.3762/bjnano.15.98

• primarily occurs via transendothelial transport pathways [6][7]. Regardless of the mode of NP extravasation, active targeting strategies have been widely explored to further enhance NP accumulation in tumors and NP internalization by cancer cells [8][9]. Active targeting involves the modification of NPs

• value (1.8 nM) compared to the free PMSA-targeting ligand (4.5 nM). Urinary clearance in healthy mice was found to be 26% ID at 4 h p.i., reaching a total clearance of 53% ID at day 7. Biodistribution studies performed 24 h p.i. revealed that the particles accumulated to 5% ID/g or less in major organs

A low-kiloelectronvolt focused ion beam strategy for processing low-thermal-conductance materials with nanoampere currents

• Annalena Wolff,
• Nico Klingner,
• William Thompson,
• Yinghong Zhou,
• Jinying Lin and
• Yin Xiao

Beilstein J. Nanotechnol. 2024, 15, 1197–1207, doi:10.3762/bjnano.15.97

• cross sections and TEM lamellae of biological samples as well as of other thermally low conductive materials such as polymers [1][2][3][4][5][6][7][8][9][10][11][12][13]. The easily induced heat damage is increasingly being reported [3][6][14][15][16][17]. Despite the importance of this topic, there is

• collagen: specific heat cp = 3540 J·kg−1·K−1, density ρ = 1079 kg·m−3, thermal conductivity k = 0.29 W·m−1·K−1, and thermal diffusivity α = 1.36 × 10−7 m2·s−1. The SRIM determined heat flux is later used as input parameter for the COMSOL simulations and the numerical modelling of the heat equation. COMSOL

Synthesis, characterization and anticancer effect of doxorubicin-loaded dual stimuli-responsive smart nanopolymers

• Ömür Acet,
• Pavel Kirsanov,
• Burcu Önal Acet,
• Inessa Halets-Bui,
• Dzmitry Shcharbin,
• Şeyda Ceylan Cömert and
• Mehmet Odabaşı

Beilstein J. Nanotechnol. 2024, 15, 1189–1196, doi:10.3762/bjnano.15.96

• than free DOX. To date, several types of nanoparticles, such as liposomes, micelles, and metal-organic frameworks, have been studied to encapsulate DOX to obtain effective and non-toxic drugs [7][8]. Great attention has been paid to nanoparticles because of their specific properties, such as small size

• /L loaded DOX (i.e., approx. 2 µmol/L released DOX) to 52 ± 7%. This is close to the effect of pure DOX on cells under the same conditions (Figure 6). It means that DOX is continuously released from SNPs during incubation with HeLa cells, and this process is prolonged in time. The slow release at pH

• of ammonia killed tumor cells on a level similar to that of free doxorubicin. Doxil without ammonia and ammonia without Doxil had a very poor cytotoxicity [40]. We obtained similar results. After 96 h of incubation, the effect of DOX-SNPs on HeLa cells at 5 µmol/L (i.e., 52% ± 7%) was comparable to

AI-assisted models to predict chemotherapy drugs modified with C₆₀ fullerene derivatives

• Jonathan-Siu-Loong Robles-Hernández,
• Dora Iliana Medina,
• Katerin Aguirre-Hurtado,
• Marlene Bosquez,
• Roberto Salcedo and
• Alan Miralrio

Beilstein J. Nanotechnol. 2024, 15, 1170–1188, doi:10.3762/bjnano.15.95

• . In the United States, 300,590 cases of breast cancer had been estimated for the year 2023, with a total of 43,700 deaths [6]. Latin America has over 210,000 new cases and around 60,000 deaths yearly [7]. For the year 2020, it was estimated that about 2.3 million breast cancer cases were diagnosed in

• are HER2-positive, overexpressing Erb-B2 receptor tyrosine kinase 2 (ERBB2) in the cell membrane. HER2 tumors are usually more aggressive than other ones, but the advantage is that their treatment is very effective [15]. Another chemotherapy target is the chemokine C-X-C motif receptor 7 (CXCR7) [16

• obtained by molecular docking and the predictive models for the drug–C60 complexes. Table 7 shows the values obtained for the different evaluation metrics for each predictive model. The MSE ranges from 0.44 to 12.77 kcal2/mol2, and the MAPE varies from 4.97 to 31.5%. The MAE ranged from 0.5 to 3.26 kcal

Quantum-to-classical modeling of monolayer Ge₂Se₂ and its application in photovoltaic devices

• Anup Shrivastava,
• Shivani Saini,
• Dolly Kumari,
• Sanjai Singh and
• Jost Adam

Beilstein J. Nanotechnol. 2024, 15, 1153–1169, doi:10.3762/bjnano.15.94

• -term instability, poor device scalability, and the use of toxic compounds, have yet to be resolved [6]. Recent advancements have seen the integration of two-dimensional (2D) materials with PSCs, opening new avenues for enhancing their performance and addressing current challenges with the PSCs [7][8

Introducing third-generation periodic table descriptors for nano-qRASTR modeling of zebrafish toxicity of metal oxide nanoparticles

• Supratik Kar and
• Siyun Yang

Beilstein J. Nanotechnol. 2024, 15, 1142–1152, doi:10.3762/bjnano.15.93

• strong antibacterial, antifungal, antidiabetic, antioxidant, anticancer, and photocatalytic activities [7][8][9]. Besides the medical field, they are also commonly used in commercial products such as fuel cells and plastics, and environmental applications such as analysis, sensing, remediation, and

Photocatalytic methane oxidation over a TiO₂/SiNWs p–n junction catalyst at room temperature

• Qui Thanh Hoai Ta,
• Luan Minh Nguyen,
• Ngoc Hoi Nguyen,
• Phan Khanh Thinh Nguyen and
• Dai Hai Nguyen

Beilstein J. Nanotechnol. 2024, 15, 1132–1141, doi:10.3762/bjnano.15.92

• deposition on catalyst surfaces [4][5][6][7]. Therefore, sustainable strategies for both green conversion and atmospheric removal of CH4 are urgently necessary [8][9][10][11]. Semiconductor-based photocatalysis has been attracting scientists’ attention because of its environmental friendliness and easy

• recorded in a batch reactor under different wavelengths of light. As shown in Figure 6b, no products were detected under the visible-light irradiation. The photocatalytic performance under UV illumination was significantly lower than that under full illumination. Figure 7 shows the recyclability of the p–n

Local work function on graphene nanoribbons

• Daniel Rothhardt,
• Amina Kimouche,
• Tillmann Klamroth and
• Regina Hoffmann-Vogel

Beilstein J. Nanotechnol. 2024, 15, 1125–1131, doi:10.3762/bjnano.15.91

• ] and p-doping by Bi, Sb, and Au substrates [2]. Confining graphene to nanostructures [6][7], for example, to graphene nanoribbons (GNRs), that is, few nanometers wide stripes of graphene, opens additional possibilities of tuning the electronic properties by creating quantum-confined states [8] and

• (f0 = 292 kHz, cL = 41 N/m) were used for imaging in the frequency modulation (FM) mode operated by a Nanonis electronic system. The tips were cleaned by sputtering (Ar pressure 5 × 10−3 Pa, energy 1 keV, 15 min) and annealing up to 375 K for 1–5 h (pressure below 1 × 10−7 Pa) prior to measurement

Direct electron beam writing of silver using a β-diketonate precursor: first insights

• Katja Höflich,
• Krzysztof Maćkosz,
• Chinmai S. Jureddy,
• Aleksei Tsarapkin and
• Ivo Utke

Beilstein J. Nanotechnol. 2024, 15, 1117–1124, doi:10.3762/bjnano.15.90

• fragmentation of adsorbed precursor molecules on a substrate [5][6][7][8][9]. The precursor is typically supplied in gaseous phase. Exploiting the different complex pathways in electron-induced chemistry (such as formation of unstable intermediates and thermal assistance in adsorption and desorption) and the

• in scanning electron microscopes during deposition, a double layer of water is still present on hydrophilic surfaces. This turns water into a natural co-reactant of direct electron beam writing [7] and helps in the formation of neutral volatile reaction products from the ligands, such as CO, CO2, CH4

• (dose 1.5 × 10−7 C) and the pillar width of 320 nm, this corresponds to a volume growth rate of approximately 0.012 μm3 per minute and a vertical growth rate of about 200 nm per minute. The obtained vertical growth rate was sufficient to avoid any signs of halo evolution around the structure (Figure 3a

Recent updates in applications of nanomedicine for the treatment of hepatic fibrosis

• Damai Ria Setyawati,
• Fransiska Christydira Sekaringtyas,
• Riyona Desvy Pratiwi,
• A’liyatur Rosyidah,
• Rohimmahtunnissa Azhar,
• Nunik Gustini,
• Gita Syahputra,
• Idah Rosidah,
• Etik Mardliyati,
• Tarwadi and
• Sjaikhurrizal El Muttaqien

Beilstein J. Nanotechnol. 2024, 15, 1105–1116, doi:10.3762/bjnano.15.89

• macromolecular drugs and higher retention. Figure 1 was reproduced from [7] (© 2023 P. Shi et al., published by BMC, distributed under the terms of the Creative Commons Attribution 4.0 International License, https://creativecommons.org/licenses/by/4.0). Schematic illustration of (a) passive and (b) active

Unveiling the potential of alginate-based nanomaterials in sensing technology and smart delivery applications

• Shakhzodjon Uzokboev,
• Khojimukhammad Akhmadbekov,
• Ra’no Nuritdinova,
• Salah M. Tawfik and
• Yong-Ill Lee

Beilstein J. Nanotechnol. 2024, 15, 1077–1104, doi:10.3762/bjnano.15.88

• environment, and industry [1][2][3][4][5][6][7]. When employing these technical devices, users can chose user-friendly, cost-effective, sensitive, and error-free detecting instruments [8]. The field of biosensors has received a lot of interest over the last years because of their amazing capacity for early

• the initial 120 h. Furthermore, in vitro tests showed the effective inhibition of MCF-7 human breast cells without any damage to human dermal fibroblasts (HDFs). The created new alginate-based nanoplatform can be used in targeted and prolonged drug delivery of capsaicin in cancer prevention and

• frequent drug administration. Scientists prepared alginate nanoparticles coated with the two biopolymers chitosan and gelatin. The results demonstrated better encapsulation efficacy (40%) and loading capacity (7%). In addition, in vitro drug release experiments indicated a sustained drug release over 120 h

Signal generation in dynamic interferometric displacement detection

• Knarik Khachatryan,
• Simon Anter,
• Michael Reichling and
• Alexander von Schmidsfeld

Beilstein J. Nanotechnol. 2024, 15, 1070–1076, doi:10.3762/bjnano.15.87

• Knarik Khachatryan Simon Anter Michael Reichling Alexander von Schmidsfeld Institut für Physik, Universität Osnabrück, Barbarastr. 7, 49076 Osnabrück, Germany 10.3762/bjnano.15.87 Abstract Laser interferometry is a well-established and widely used technique for precise displacement measurements

• displacement of a (quasi) harmonically oscillating microcantilever, acting as one mirror of the interferometer, while the second mirror is the even surface of an optical fiber delivering the light to the microcantilever [5][6][7][8][9][10]. As illustrated in Figure 1, interference occurs in the optical fiber

• = 0.81) aluminum-coated silicon microcantilever (type PPP-NCLR, NanoWorld AG, Neuchâtel, Switzerland) having dimensions of (225 ± 10) μm × (38 ± 8) μm × (7 ± 1) μm according to the specification of the manufacture. Using our standard procedure [15], we determined the eigenfrequency as f0 = 169.67622 kHz

Effect of wavelength and liquid on formation of Ag, Au, Ag/Au nanoparticles via picosecond laser ablation and SERS-based detection of DMMP

• Sree Satya Bharati Moram,
• Chandu Byram and
• Venugopal Rao Soma

Beilstein J. Nanotechnol. 2024, 15, 1054–1069, doi:10.3762/bjnano.15.86

• ]. The properties of NPs, such as size, shape, crystallinity, productivity, and composition, can be influenced by several experimental parameters during synthesis [4][6][7][8][9][10]. The impact of laser parameters, such as pulse duration, wavelength, repetition rate, and fluence, and of the liquid

• the generation of the NPs. The presence of electrostatic repulsion among charged NPs generated in an electrolyte solution reduces the average size of the NPs. Rehbock et al. [21] pointed out the size reduction in Au NPs from 30 nm at 3 µM to 7 nm at 500 µM in the presence of aqueous NaCl solution

• were investigated using FESEM. The FESEM images reported in Figure 6 depict a filter paper surface grafted with Ag NPs, categorized as: (a) AgDW1, (b) AgD2, (c) AgD3, (d) AgN1, (e) AgN2, and (f) AgN3. Similarly, a FP loaded with Ag/Au NPs is illustrated in Figure 7, categorized as: (a) AgAuD1, (b

Interface properties of nanostructured carbon-coated biological implants: an overview

• Mattia Bartoli,
• Francesca Cardano,
• Erik Piatti,
• Stefania Lettieri,
• Andrea Fin and
• Alberto Tagliaferro

Beilstein J. Nanotechnol. 2024, 15, 1041–1053, doi:10.3762/bjnano.15.85

• Materiali (INSTM), Via G. Giusti 9, 50121, Firenze, Italy Department of Chemistry, University of Turin, Via P. Giuria 7, 10125 Torino, Italy Department of Applied Science and Technology, Politecnico di Torino, Corso Duca Degli Abruzzi, 24, 10129, Torino, Italy 10.3762/bjnano.15.85 Abstract The interfaces

• applications [4] as active species or as drug delivery platforms using tailored carbon nanotubes (CNTs) [5][6], fullerenes [7][8], carbon dots (CDs) [9][10], and graphene-related materials (i.e., graphene oxide (GO) [11], reduced graphene oxide (rGO) [12], and nanographite (nG) [13]). Furthermore, the

Bolometric IR photoresponse based on a 3D micro-nano integrated CNT architecture

• Yasameen Al-Mafrachi,
• Sandeep Yadav,
• Sascha Preu,
• Jörg J. Schneider and
• Oktay Yilmazoglu

Beilstein J. Nanotechnol. 2024, 15, 1030–1040, doi:10.3762/bjnano.15.84

• (TCR) [6], and high mechanical stability [7]. Vertically aligned CNTs (VACNTs) are considered to be nearly ideal blackbody absorbers because of their ability to absorb light over a broad spectral range (0.2–200 μm), closely resembling the theoretical blackbody that absorbs all wavelengths of light [3

• of the M-shaped bolometer design. The final design with a micro-nano integration using optimized contacts between the Cr/Au pads and the M-shaped CNT block can then be achieved with additional CNT blocks on the Cr/Au pads as shown in [7]. Furthermore, this research embarks on a comprehensive

• from similar CNT growth conditions have been published in previous works [7][15]. It was shown that more than 90% of the CNTs grown on the Si wafer were double-walled carbon nanotubes (DWCNTs). The new TEM micrograph in Figure 3a shows the DWCNTs. Diameter and chirality of the carbon nanotubes are

Entry of nanoparticles into cells and tissues: status and challenges

• Kirsten Sandvig,
• Tore Geir Iversen and
• Tore Skotland

Beilstein J. Nanotechnol. 2024, 15, 1017–1029, doi:10.3762/bjnano.15.83

• Nanoparticle Uptake The complexity of endocytosis The field of endocytosis has undergone a remarkable development during the last decades. Today it is clear that there is a variety of uptake mechanisms in cells, and adding to the complexity, they are partially cell-type specific [7][8][9][10]. In Figure 1, we

• phagocytes [7][8][9][10]). Endophilin is a player when it comes to both clathrin-mediated endocytosis (CME) and FEME, which is an endocytic mechanism induced by growth factors [7][8]. It should be noted that FEME is dependent on the formation of endophilin-positive assemblies on the plasma membrane, and this

• step in FEME is blocked by a number of inhibitors that target other mechanisms [11]. Importantly, dynamin is required for the formation of vesicles by numerous mechanisms [7][8], but was recently reported to stabilize some caveolae [12]. Furthermore, when interfering with one uptake mechanism, the cell

Ca_n neutral clusters: a two-step G₀W₀ and DFT benchmark

• Sunila Bakhsh,
• Sameen Aslam,
• Muhammad Khalid,
• Muhammad Sohail,
• Sundas Zafar,
• Sumayya Abdul Wadood,
• Kareem Morsy and
• Muhammad Aamir Iqbal

Beilstein J. Nanotechnol. 2024, 15, 1010–1016, doi:10.3762/bjnano.15.82

• clusters occurs above the trimer cluster. Small calcium clusters (2–5) have been investigated using first-principles calculations incorporating the electron correlation effects [4][5][6][7]. In 3D cluster structures, it can be used in the manufacturing of coating materials, which is useful for high

• ground state of Ca2 has a low binding energy of 0.14 eV. Our dimer results are also significantly closer to the reported experimental and theoretical work [13][17]. The binding energies also increase rapidly up to cluster size n = 7. A decrease in binding energy is seen at n = 8, likely due to the shell

• , we can also analyze Ca7 whose binding energy is much higher in the series of clusters as shown in Figure 2. The higher binding energy depicts higher stability, which can be confirmed by the second difference analysis (see Figure 3). Another possible reason for the drop in binding energy from n = 7–8