Skip to content

Simultaneous determination of the lattice thermal conductivity and grain/grain thermal resistance in polycrystalline diamond

MetadataDetails
Publication Date2017-08-09
JournalActa Materialia
AuthorsJ. Anaya, Tingyu Bai, Yekan Wang, C. Li, Mark S. Goorsky
InstitutionsGeorgia Institute of Technology, University of California, Los Angeles
Citations74
AnalysisFull AI Review Included

Technical Analysis of Thermal Transport in Near-Nucleation Polycrystalline Diamond

Section titled ā€œTechnical Analysis of Thermal Transport in Near-Nucleation Polycrystalline Diamondā€

Documentation based on: Anaya et al. (2017). Simultaneous determination of the lattice thermal conductivity and grain/grain thermal resistance in polycrystalline diamond. Acta Materialia.


This research utilizes advanced metrology (Raman thermography + picosecond TDTR) combined with real grain structure modeling (TEM + FEM) to precisely characterize the thermal performance of ultra-thin (1 µm) polycrystalline diamond (PCD) near the nucleation region—a critical thermal bottleneck in GaN-on-Diamond High Electron Mobility Transistor (HEMT) applications.

  • Precise Quantification: Simultaneous determination of intrinsic lattice thermal conductivity ($\kappa_{in-grain}$) and grain/grain thermal resistance ($R_{GB}$) using a sophisticated, non-adjustable parameter methodology.
  • Low Lattice Conductivity: The in-grain lattice thermal conductivity ($\kappa_{in-grain}$) was found to be exceptionally low (250 W/mK), 5-8 times smaller than typical Type IIa single-crystal diamond (SCD), indicating a high density of defects (e.g., Si inclusion, dislocations).
  • High Boundary Resistance: Grain boundary resistance ($R_{GB}$) was measured at 0.625 m²K/GW, significantly higher (at least one order of magnitude) than predicted values for clean boundaries, confirming high defect accumulation at grain boundaries.
  • Anisotropy Mechanism: The observed thermal anisotropy ($\kappa_{cross-plane}$ is higher than $\kappa_{in-plane}$) naturally emerges from the PCD’s characteristic columnar grain structure combined with the high thermal resistance of these boundaries.
  • Application Relevance: These findings are crucial for optimizing MPCVD growth recipes to improve thermal management, especially in the demanding near-nucleation layers used for critical electronic integration (e.g., GaN HEMT heat spreaders).

Extracted quantitative parameters derived from the MPCVD diamond film and experimental setup.

ParameterValueUnitContext
Film Thickness~1.0 - 1.1µmPolycrystalline Diamond (PCD) Film
Substrate Thickness200µmSilicon (Si) Substrate
Average In-Plane TC ($\kappa_{in-plane}$)95 ± 10W/mKMeasured experimentally
Average Cross-Plane TC ($\kappa_{cross-plane}$)175 +65/-42W/mKMeasured experimentally via TDTR
Fitted In-Grain Lattice TC ($\kappa_{in-grain}$)250 (150 to 400)W/mKDetermined via TEM/FEM model
Fitted Grain/Grain Thermal Resistance ($R_{GB}$)0.625 (0.26 to 1.06)m²K/GWDetermined via TEM/FEM model
Diamond/Si TBR ($R_{dia-Si}$)13.7 +3.8/-3.5m²K/GWMeasured via TDTR
Al/Diamond TBR ($R_{Al-dia}$)5.6 +0.6/-0.5m²K/GWMeasured via TDTR
Average Grain Size (TEM)184nmDetermined via Transmission Electron Microscopy
Nucleation Seed Density> 1012nuclei/cm2Detonation nanodiamond powder
TDTR Pump Beam Diameter (1/e²)40µmMeasurement configuration
TDTR Probe Beam Diameter (1/e²)14µmMeasurement configuration

The study employed a rigorous, multi-modal approach combining specialized MPCVD synthesis, high-resolution structural analysis, advanced thermal metrology, and sophisticated finite element modeling.

  1. MPCVD Growth:

    • Reactor: IPLAS 5.0 KW CVD reactor.
    • Substrate: 200 µm thick Silicon (Si).
    • Seeding: Ultrasonic treatment using ethanol-based detonation nanodiamond suspension (4 nm average size, > 98% purity).
    • Recipe Parameters (Constant): Substrate Temperature 750 °C; Chamber Pressure 7.08 torr.
    • Recipe Parameters (Varied): Microwave Power (800 W to 1400 W) and CH4:H2 ratio (0.5% to 0.7%) over the growth duration.
  2. Structural Characterization:

    • TEM/STEM: Transmission Electron Microscopy (TEM) and Scanning Transmission Electron Microscopy (STEM) (Titan S/TEM, 200 kV) were used to extract the real 2D grain structure, grain size distribution (184 nm average), and grain orientation maps (PED).
    • Structural Finding: Confirmed well-pronounced columnar grain structure with a preferred out-of-plane (110) orientation.
  3. Thermal Conductivity Measurements:

    • In-Plane TC (Raman Thermography): Diamond membranes (460x1000 µm) were fabricated via Si etching. Cr (20 nm)/Au (300 nm) line heaters were patterned. Temperature profiles were measured using Raman spectroscopy assisted by 30 nm TiO2 nanoparticles as nanosensors.
    • Cross-Plane TC (Picosecond TDTR): Time Domain Thermoreflectance was used. A 90 nm Al layer was deposited as a transducer on the diamond film/Si substrate stack. Measurements were performed using a Ti:sapphire laser (800 nm, 80 MHz) frequency-doubled to 400 nm, allowing simultaneous fitting of $\kappa_{cross-plane}$ and both interfacial Thermal Boundary Resistances ($R_{dia-Si}$, $R_{Al-dia}$).
  4. Modeling and Analysis (FEM):

    • The experimentally derived real grain structure (from TEM) was imported into a COMSOL Multiphysics Finite Element Model (FEM).
    • The model solved the heat equation under equivalent experimental conditions (steady-state for in-plane, transient for cross-plane) for a 2D slab containing >1000 grains and >7500 boundaries.
    • This methodology allowed for the simultaneous and unique determination of $\kappa_{in-grain}$ and $R_{GB}$ without relying on arbitrary fitting parameters or bulk-like approximations.

This research highlights the critical challenges inherent in the thermal management of diamond nucleation layers, particularly the low in-grain thermal conductivity (250 W/mK) and high grain boundary resistance ($R_{GB}$) found in thin-film PCD. 6CCVD is uniquely positioned to supply the materials required to replicate this research and the high-performance materials necessary to overcome these thermal bottlenecks in advanced applications like GaN HEMT technology.

Research Requirement6CCVD Material Solution6CCVD Engineering Capability
Near-Nucleation PCD FilmsNanocrystalline/Thin-Film PCDSupply of PCD material up to 500 µm thick, mirroring the properties required for advanced thin-film thermal analysis.
High TC Heat SpreadersOptical Grade SCD WafersSCD (up to 500 µm) offers inherent high $\kappa$ (>2000 W/mK) and eliminates grain boundaries, solving the $R_{GB}$ and low $\kappa_{in-grain}$ problems highlighted in the paper.
Custom DimensionsPCD and SCD Wafers up to 125mm6CCVD supplies inch-size wafers for large-area industrial integration, supporting the scale-up from experimental membranes to commercial devices.
Experimental Structure FabricationAdvanced Metalization ServicesThe paper required Cr/Au and Al deposition. 6CCVD offers in-house custom metalization stacks, including Ti, Pt, Au, Pd, W, and Cu, tailored for heater patterning or high-performance thermal interfaces (e.g., GaN-on-Diamond bonding).
Surface QualityPrecision Polishing (Ra < 5 nm)The structural analysis required high-quality surfaces. 6CCVD offers superior polishing for PCD (Ra < 5 nm) and SCD (Ra < 1 nm), crucial for reliable TDTR measurements and subsequent device integration.
Thermal Testing ReplicationEngineering SupportOur in-house PhD team provides consultative support for material selection, growth recipe modification assistance, and thermal stack optimization for similar GaN HEMT thermal management projects.
Global LogisticsDDU and DDP ShippingGlobal delivery services (DDU default, DDP available) ensure researchers receive materials quickly and reliably worldwide.

For custom specifications or material consultation, visit 6ccvd.com or contact our engineering team directly.

  1. 1967 - Continuous operation of GaAs junction lasers on diamond heat sinks at 200 °K [Crossref]
  2. 2008 - Diamond heat spreader layer for high-power thin-GaN light-emitting diodes [Crossref]
  3. 1992 - On diamond windows for high power synchrotron x-ray beams [Crossref]
  4. 2014 - Enhancement of hotspot cooling with diamond heat spreader on Cu microchannel heat sink for GaN-on-Si device [Crossref]
  5. 2001 - Thermal conductivity measurements on CVD diamond [Crossref]
  6. 2016 - Effect of grain size of polycrystalline diamond on its heat spreading properties [Crossref]
  7. 1992 - Anisotropic thermal conductivity in chemical vapor deposition diamond [Crossref]
  8. 2016 - Control of the in-plane thermal conductivity of ultra-thin nanocrystalline diamond films through the grain and grain boundary properties [Crossref]
  9. 2016 - Thermal management of GaN-on-diamond high electron mobility transistors: effect of the nanostructure in the diamond near nucleation region
  10. 2007 - Comparison of GaN HEMTs on diamond and SiC substrates [Crossref]