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The Charge Transport Properties of Polycrystalline CVD Diamond Films Deposited on Monocrystalline Si Substrate

MetadataDetails
Publication Date2025-10-07
JournalCoatings
AuthorsK. Paprocki, K. Fabisiak, Szymon Ɓoƛ, W. Kozera, Tomasz Knapowski
InstitutionsPoznaƄ University of Technology, University of Bydgoszcz
AnalysisFull AI Review Included

This study investigates the structural quality and charge transport mechanisms in undoped polycrystalline CVD diamond films deposited directly onto n-type silicon (Si) substrates, forming p-diamond/n-Si heterojunctions.

  • Core Achievement: Successful fabrication and electrical characterization of p-diamond/n-Si heterojunctions exhibiting rectifying diode behavior, with transport mechanisms analyzed via Thermionic Emission (TE) and Space-Charge-Limited Conduction (SCLC) theories.
  • Quality Correlation: A strong inverse correlation was established between structural quality (Raman Q factor) and trap state density, confirming that higher crystalline perfection leads to superior electronic performance.
  • Transport Limitation: Charge transport is dominated by bulk defects within the polycrystalline diamond layer (SCLC regime), rather than the junction interface, limiting performance.
  • Ideality Factor: Measured ideality factors (n) were high, ranging from 1.6 to 6.4, indicating significant deep trap states with densities between 0.5 x 1016 and 8.9 x 1016 eV-1cm-3.
  • Mobility: Extracted hole mobilities (”p) were low (0.00143 to 0.01867 cm2/Vs), confirming that grain boundary trapping is the dominant mobility-limiting factor in these CVD films.
  • Best Sample Performance: Sample PDF15 exhibited the highest structural quality (Q = 98.90%) and the best electrical performance (lowest n = 1.6, highest ”p = 0.01867 cm2/Vs).
ParameterValueUnitContext
Diamond Film Thickness4-6”mPolycrystalline CVD films
Si Substrate Type(100) n-typeOrientation/TypeResistivity: 3.5 Ω·cm
Filament Temperature2300 ± 50KHF CVD growth parameter
Substrate Temperature980 ± 30KHF CVD growth parameter
Gas Flow Rate100 ± 5sccmTotal flow rate
CH4/H2 Ratio Range2.30 - 2.75%Varies by sample
Deposition Pressure Range20 - 100mbarVaries by sample
Crystallite Size Range (L(220))57 - 71nmDetermined by XRD (Scherrer formula)
Diamond Quality (Q) Range97.65 - 98.90%Estimated via Raman spectroscopy
Raman Peak Position1331.5cm-1Characteristic diamond peak
Ideality Factor (n) Range1.6 - 6.4DimensionlessThermionic Emission regime (0-0.3 V)
Trap Density (Nt) Range0.519 - 8.915x 1016 eV-1cm-3Calculated from ideality factor
Hole Mobility (”p) Range0.00143 - 0.01867cm2/VsExtracted from SCLC regime
Diamond Bandgap (Eg)5.47eVIntrinsic property of diamond

The polycrystalline diamond films were synthesized using the Hot Filament Chemical Vapor Deposition (HF CVD) method, followed by comprehensive structural and electrical characterization.

  1. Substrate Preparation:
    • (100)-oriented n-type Si substrates (3.5 Ω·cm) were used.
    • Polishing was performed using 0.2 ”m diamond paste.
    • Seeding involved immersion in an ultrasonic bath containing nano/microdiamond powders in methanol (30 min).
    • Final cleaning utilized alcohol and acetone (5 min).
  2. HF CVD Deposition Parameters:
    • Filament Material/Temperature: Tungsten, 2300 ± 50 K.
    • Substrate Temperature: 980 ± 30 K.
    • Gas Mixture: CH4/H2 (2.3%-2.75% CH4 ratio).
    • Total Gas Flow Rate: 100 ± 5 sccm.
    • Deposition Pressure: Varied between 20 and 100 mbar.
    • Deposition Rate: Approximately 0.4-0.5 ”m/h.
  3. Device Fabrication:
    • Gold contacts (5 mm diameter) were thermally evaporated onto both the diamond surface and the backside of the Si substrate to form the heterojunction device.
  4. Structural Characterization:
    • Morphology: Scanning Electron Microscopy (SEM).
    • Crystalline Structure: X-ray Diffraction (XRD) used to determine crystallite sizes (57-71 nm) via the Scherrer formula on the (220) reflection.
    • Quality Assessment: Raman spectroscopy (488 nm laser) used to calculate the Diamond Quality Q factor based on the ratio of the diamond peak (ID) to the amorphous carbon G-band (IG).
  5. Electrical Characterization:
    • I-V characteristics were measured at room temperature (RT) using an Oxford Optistat cryostat.
    • Transport analysis focused on three regimes: Ohmic (J proportional to V), Thermionic Emission (In(J) proportional to V), and Space-Charge-Limited Conduction (SCLC, J proportional to V2).
    • Key parameters (ideality factor $n$, trap density $N_t$, and hole mobility $\mu_p$) were extracted from the slopes of the I-V and J-V2 plots.

The development of robust diamond/silicon heterojunctions is critical for next-generation electronics that require extreme performance characteristics.

  • High-Power and High-Frequency Devices:
    • Rectifying Diodes and Schottky Devices: Utilizing diamond’s high breakdown voltage and high thermal conductivity (superior heat dissipation) for power electronics operating above 300 °C.
    • RF/Microwave Components: Leveraging the low dielectric constant for high-frequency applications.
  • Radiation Hard Electronics:
    • Radiation Detectors: Diamond’s superior radiation hardness makes it ideal for sensors and electronics used in space, nuclear reactors, and high-energy physics experiments where conventional silicon devices fail due to defect accumulation.
  • Extreme Environment Sensors:
    • High-Temperature Sensing: The wide bandgap ensures stable electronic operation in environments exceeding the limits of Si and SiC.
  • Optoelectronics:
    • UV Emitters and Detectors: Potential use in deep UV applications, although controlling defect states (which limit mobility) is essential for achieving high quantum efficiency.
View Original Abstract

In this work, diamond/Si heterojunctions were fabricated by synthesizing a diamond layer directly on a monocrystalline n-type Si substrate. The diamond layers were characterized using micro-Raman spectroscopy, scanning electron microscopy (SEM), and X-ray diffraction (XRD). The current-voltage (I-V) characteristics of the heterojunctions were measured at room temperature. The heterojunctions exhibited rectifying behavior, confirming their diode-like nature. Based on thermionic emission theory, key electrical parameters of the heterojunction diodes—including the ideality factor (n) and carrier mobility (ÎŒ)—were estimated from the I-V characteristics. The I-V curves revealed large ideality factors ranging from 1.5 to 6.5, indicating the presence of deep trap states with densities between 2 × 1015 and 8 × 1016 eV−1·cm−3. These variations were attributed to differences in the structural quality of the diamond layers and the effects of surface hydrogen termination.

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