| Literature DB >> 33365372 |
Abstract
The data presented in this paper are related to the research article entitled "Pulsed laser deposition of single phase n- and p-type Cu2O thin films with low resistivity" (S.F.U. Farhad et al., 2020) [1]. The detailed processing conditions of copper oxide thin films and a variety of characterization techniques used are described in the same ref. [1]https://doi.org/10.1016/j.matdes.2020.108848. Thin films need to grow on different substrates to elucidate various properties of the individual layer for attaining optimum processing conditions required for devising efficient optoelectronic junctions as well as thin film stacks for different sensing applications. This article describes the effect of substrate temperature and oxygen partial pressure on the structural, morphological, optical, and electrical properties of pulsed laser deposited (PLD) nanocrystalline copper oxide thin films on quartz glass, ITO, NaCl(100), Si(100), ZnO coated FTO substrates. The low temperature grown copper oxide and zinc oxide thin films by PLD were used for devising solid n-ZnO/p-Cu2O junction and investigated their photovoltaic and interface properties using dynamic photo-transient current measurement at zero bias voltage and TEM/EDX respectively. These datasets are made publicly available for enabling extended analyses and as a guide for further research.Entities:
Keywords: Bi-axial stress; Copper oxide thin film; Dynamic photo-transient current; Energy dispersive x-ray (EDX); Pulsed Laser Deposition (PLD); Transmission Electron Microscopy (TEM); ZnO/Cu2O based junction
Year: 2020 PMID: 33365372 PMCID: PMC7749377 DOI: 10.1016/j.dib.2020.106644
Source DB: PubMed Journal: Data Brief ISSN: 2352-3409
PLD process conditions used for producing copper oxide thin film. Base vacuum of PLD chamber ≤ 10−6 mTorr; Target substrate distance ∼ 5 cm
| Process parameter | Tsub (°C) | O2pp (mTorr) | LP (mJ) (spot size ∼ 0.18 × 0.09 cm2) |
|---|---|---|---|
| Growth temperature | 25 – 400 | 10 | 25 |
| 25 – 300 | 3 | ||
| Background gas pressure | 25 | 0 – 7 | 25 |
| 200 | 0 – 7 | ||
| Substrates | With constant Tsub, O2pp and LP | ||
| Crystalline: NaCl(100), and Si(100) | Polycrystalline (conducting):ITO, FTO, ZnO, AZO | Amorphous (insulating): Quartz glass | |
Fig. 1Schematic diagram of the PLD setup used for depositing copper oxide and zinc oxide thin films in this study.
Copper oxide phases in the deposited films estimated from the XRD results shown in the Fig. S1 of ref. [1]. Optimum deposition conditions for phase pure Cu2O are highlighted (Bold font).
| Copper oxide phase fraction (%) | |||||||
|---|---|---|---|---|---|---|---|
| O2pp ≈ 10 mTorr | O2pp ≈ 3 mTorr | ||||||
| Tsub (°C) | Cu | Cu2O | CuO | Cu | Cu2O | CuO | CuxOy |
| - | 40 | 60 | - | - | - | ||
| 100 | - | 48 | 52 | 1 | 55 | - | 44 |
| - | 93 | 7 | - | - | 15 | ||
| 300 | 11 | 89 | - | 1 | 34 | - | 65 |
| 400 | 6 | 94 | - | ||||
| Ann@550 0C | - | - | 100 | - | - | 100 | - |
Deconvolution resulted a peak at 2θ ≈ 43.420 which could be assigned to Cu (111)
Fig. 2The average crystalline domain size (a) and lattice constant (b) variation as a function of substrate temperature. The horizontal dashed line in panel (b) indicates the bulk lattice constant value (a ≈ 0.427 nm) of pure copper oxide.
Bi-axial strain-stress related calculations for cubic crystals of (111) and (200) reflection estimated from the XRD results shown in the Fig. S1b in the supplementary material of ref. [1]. Large compressive strains for CuxOy phase parallel to the substrate are highlighted (Bold font).
| Tsub (°C) | Phase | ε|| (111) | ε|| (200) | σ|| (111) | σ|| (200) | ||||
|---|---|---|---|---|---|---|---|---|---|
| 25 | Cu2O | 4.24 | 4.25 | -0.7 | -0.5 | 0.4 | 0.3 | 12.6 | 9.5 |
| 100 | CuxOy | 4.32 | 4.36 | 1.2 | 2.1 | -18.9 | -37.8 | ||
| Cu2O | 4.27 | 4.25 | 0 | -0.5 | 0 | 0.3 | 0 | 9.5 | |
| 200 | CuxOy | - | 4.34 | - | 1.6 | - | - | -28.4 | |
| Cu2O | 4.29 | 4.26 | 0.5 | -0.2 | -0.3 | 0.1 | -9.5 | 3.2 | |
| 300 | CuxOy | 4.32 | 4.36 | 1.2 | 2.1 | -18.9 | -37.8 | ||
| Cu2O | 4.27 | 4.26 | 0 | -0.2 | 0 | 0.1 | 0 | 3.2 |
Fig. 3The variation of lattice constant of cuprous oxide films deposited at Tsub ≈ 25 °C (denoted by ■) and Tsub ≈ 200 °C (denoted by ▲) as a function of O2pp. The horizontal dashed line indicates the bulk lattice constant value (a ≈ 0.427 nm) of pure copper oxide.
Fig. 4Room temperature Raman spectra (a) (reproduced from the supplementary material of ref. [1]) and Photoluminescence (PL) spectra (b) of copper oxide thin films deposited at Tsub ≈ 25 °C – 300 °C onto quartz substrate with a constant laser pulse energy (LP ≈ 25±4 mJ) and O2pp ≈ 3 mTorr. The vertical lines indicate the reference vibrational modes and luminescence peaks of copper oxide [1], [2], [3].
Fig. 5SEM micrographs of copper oxide thin films deposited on (a) ITO, (b) NaCl(100), and (c) quartz glass substrate using O2pp ≈ 5 mTorr.
Fig. 6SEM micrographs of ZnO thin film grown on FTO substrate (a). The inset in (a) shows the surface morphology of the blank FTO. Al-doped ZnO (AZO) thin film on soda lime glass (b). The inset in (b) shows the zoomed area of the same sample. AZO thin film grown on ITO coated glass (c). Both ZnO and AZO thin films were also grown by PLD at O2pp ≈ 10 mTorr _Tsub ≈ 300 °C and O2pp ≈ 10 mTorr _Tsub ≈ 400 °C respectively.
Fig. 7Photograph of a typical PLD-grown solar cell of Au/FTO/ZnO/Cu2O/Au structure (a); A schematic of the photocurrent measurement setup using the IVIUM potentiostat/galvanostat as a source measure unit (SMU) (b). The characteristic J-V curve of under dark and under 528 nm-LED illumination (c), a zoomed area of the J-V curve near zero bias voltage shown in the inset of (c). Transient photocurrent of the same cell measured under periodic LED illumination (d), where ‘On’ and ‘Off’ steps of the transient photocurrent is demonstrated by the dotted curve to assist the reader.
Fig. 8Focused Ion Beam (FIB) assisted cross-sectional specimen preparation of Cu2O/ZnO stack (a); SEM micrograph of the same FIB specimen (b): Cu2O (∼53 nm), and ZnO (∼114 nm) layer. Platinum (Pt)-plate was used to protect thin layers during FIB cross-sectional specimen preparation. TEM Bright field image of the FIB cross-sectional sample (c): The EDX spectra of the amorphous interface layer between ZnO and Cu2O at site#1 (d) and site#2 (e) (marked by arrows in c).
Crystallographic and physical properties of Cu2O and CuO ([3,[6], [7], [8], [9], [10], [11], [12]]).
| Properties | Cu2O (cubic) | CuO (monoclinic) |
|---|---|---|
| Lattice constant | 4.2696±0.0010 Å | |
| Cu–O bond length | 1.85 Å | 1.96 Å |
| O–O separation | 3.68 Å | 2.62 Å |
| Cu–Cu separation | 3.02 Å | 2.90 Å |
| Density | 6.10 g/cm3 | 6.52 g/cm3 |
| Molar mass, M | 143.14 g/mol | 79.57 g/mol |
| Melting point | 1235 0C | 1326 0C[12] |
| Boiling point | 1800 0C | 2000 0C[12] |
| Young's modulus | 30.12 GPa | 81.6 GPa |
| Thermal expansion coefficient | 2.3 × 10−7 K−1 (283 K) | (2– 6) × 10−6 K−1 (200 K)[8] |
| Dielectric constant | ε(0) = 7.11 and ε(∞) = 6.6 | ε(0) ≈ 8.00 and ε(∞) = 6.45 |
| Electron affinity (300 K) | ∼ 3.1 eV(300 K) | ∼ 4.07 eV |
| Work function | ∼ 4.84 eV (300 K) | ∼ 5.25 eV |
| Thermal conductivity | 5.2 W/(Km) | 8.6 W/(Km) |
| Specific heat capacity (300 K) | 70 J/(K mol) | 42.36 J/(K mol) |
| Subject | Materials Engineering, Physics, Electrochemistry |
| Specific subject area | Metal oxide semiconductors for optoelectronic applications |
| Type of data | Tables; Images; Figures |
| How data were acquired | X-ray Diffraction (XRD) (Bruker AXS D8 Advance), FE-SEM (JEOL JSM 6330F), Focused Ion Beam (FIB), TEM (JEOL 2010), |
| Data format | Raw and analyzed |
| Parameters for data collection | Deposited copper oxide thin films on quartz glass, ITO, NaCl (100), ZnO (PLD)/FTO etc. were characterized without further processing, except one set of films that annealed in air at 550 °C for 1 h for comparison purposes. VASE: Reflection mode, Optical diffuse reflectance: Copper oxides on quartz glass. |
| Description of data collection | Deposition of copper oxide and zinc oxide thin films on variety of substrates by Pulsed Laser Deposition (PLD). Characerization of as-grown and annealed thin films by variety of techniques and photovoltaic response measurement of solid p-Cu2O/n-ZnO junctions. The raw data for the figures can be found in the Mendeley dataset. |
| Data source location | University of Bristol, Bristol BS8 1TS, United Kingdom |
| Data accessibility | |
| Related research article | S.F.U. Farhad, D. Cherns, J. A. Smith, N. A. Fox, and D. J. Fermín, Pulsed laser deposition of single-phase n- and p-type copper oxide thin films with low resistivity, Materials & Design, 193 (2020), 108848. |