April 13, 2025

Understanding GPU for Training LLMs

A Technical Analysis of Hardware Considerations for Large Language Model Training and Inference

GPU architecture forms the backbone of modern LLM development, yet many teams struggle to fully leverage its capabilities. Understanding the technical fundamentals—from streaming multiprocessors to memory bandwidth—can dramatically improve your training efficiency and reduce costs. This guide unpacks the critical hardware concepts that directly impact your AI development pipeline.

We'll explore how GPU components like tensor cores and transformer engines accelerate matrix computations essential for transformer models. You'll learn why memory bandwidth often matters more than raw compute power and how to calculate the actual compute requirements for models of different sizes.

This knowledge translates directly to practical benefits: more efficient resource allocation, faster training cycles, and the ability to work with larger models within your existing infrastructure. These optimizations can reduce your training costs while improving model quality.

Key Topics:

  1. 1
    Core GPU components and their impact on LLM performance
  2. 2
    FLOPs calculation and Chinchilla scaling laws for optimal training
  3. 3
    Memory bandwidth constraints and HBM technology advancements
  4. 4
    NVIDIA Blackwell architecture specifications and benchmarks
  5. 5
    Parallelism techniques for distributed training at scale

GPU architecture fundamentals for LLM training

Large Language Models (LLMs) demand exceptional computational power for training. Understanding the GPU architecture that enables this processing is essential for optimizing LLM development workflows.

Streaming multiprocessors: the core processing engines

GPUs contain multiple streaming multiprocessors (SMs) that serve as the primary computation units. Each SM houses specialized processing elements including:

  1. 1

    CUDA cores

    Standard floating-point operations
  2. 2

    Tensor cores

    Matrix multiplications
  3. 3

    Transformer engines

    Automatically select optimal precision formats for each transformer layer

The basic architecture of a GPU consists of multiple SM. | Source: Streaming Multiprocessor (SM)

High-end GPUs like NVIDIA's come with transformer engines that significantly enhance performance.

Parallel processing capabilities

The parallel architecture of GPUs aligns perfectly with transformer model requirements. Tensor cores perform massively parallel matrix-multiply-accumulate operations that accelerate the matrix calculations central to transformer models. This parallelism allows GPUs to process thousands of operations simultaneously, making them vastly more efficient than CPUs for LLM training.

One SM can handle numerous parallel threads, executing matrix multiplications across multiple attention heads concurrently. This design enables the processing of large batches of tokens efficiently during training.

Memory hierarchy and bandwidth considerations

GPU memory hierarchy significantly impacts LLM training throughput. The high-bandwidth memory (HBM) in modern GPUs enables rapid data transfer between memory and computation units.

Memory Bandwidth Comparison:

Memory bottlenecks often limit training performance. When working with billions of parameters, efficiently managing the memory hierarchy becomes critical to prevent stalling computation units. Techniques like gradient checkpointing help overcome memory limitations by trading computation for reduced memory usage.

Matrix operations performance comparison

When comparing GPU versus CPU performance for transformer models, the difference is dramatic. For matrix multiplication operations found in transformer layers:

  • GPUs perform matrix operations 20-100× faster than CPUs
  • A single A100 GPU delivers 312 TFLOPS for FP16 operations
  • The same matrix operations on CPUs would require significantly more power and time

This performance gap widens as model size increases, making GPUs essential for practical LLM training.

The arithmetic intensity of transformer models—the ratio of computational operations to memory accesses—determines whether training will be compute-bound or memory-bound. Understanding this relationship helps select appropriate GPU architectures for specific model sizes.

A well-designed memory system with sufficient bandwidth is just as important as raw computational power when training large models efficiently. This foundational knowledge of GPU architecture provides the context needed to explore more specific aspects of LLM training requirements.

FLOPs and compute requirements for modern language models

Now that we've established the basics of GPU architecture, let's examine how computational demands translate to practical requirements for training large language models.

Understanding FLOPs in AI workloads

FLOPs (Floating Point Operations) measure the computational work required by large language models. This metric counts the mathematical operations needed during model training and inference. For LLMs, the rule of thumb is that inference requires approximately one to two times the number of parameters in FLOPs per token generated.

Inference Phases and Compute Characteristics:

The relationship between model size and compute is direct but not linear across all phases.

Chinchilla scaling laws and compute efficiency

Chinchilla scaling laws revolutionized our understanding of optimal LLM training. These laws demonstrate that models perform best when data and model size scale proportionally. According to research, many LLMs are undertrained for their parameter count.

This image shows two graphs about AI model training. The left graph plots "Model size" against "Training FLOPs" with curved "IsoLoss contours" showing efficiency. The right graph shows "Loss" versus "Model size" with "IsoFLOPs slices" as dashed lines. Each dot represents real-world AI models, with darker dots indicating better performance. These graphs help scientists understand how the size of AI models and the amount of computing power used to train them affect their overall performance. | Source: Training Compute-Optimal Large Language Models

Key Chinchilla Findings:

  • 70B parameter model trained on 1.4T tokens (Chinchilla) outperformed larger 280B parameter Gopher model
  • Established the concept of "compute-optimal" training
  • Challenged previous assumptions favoring increased model size over dataset size

Research suggests that models should be trained on datasets approximately 20 times larger than currently used to reach optimal performance. This compute-efficient approach yields better results while managing training costs.

Calculating compute requirements

Compute requirements for LLMs can be calculated based on three key factors:

  1. 1

    Model size (parameters)

    The total number of parameters directly affects compute needs. Each parameter requires operations during both training and inference.
  2. 2

    Context length

    Longer context windows increase computational demands quadratically in the attention mechanism due to the O(n²) relationship between sequence length and computation cost.
  3. 3

    Dataset size

    Training compute scales linearly with dataset size, requiring approximately 6 operations per parameter per training token.

Inference Compute Requirements:

  • Standard inference: ~2 × N FLOPs per token (N = number of parameters)
  • Prefill phase: 2 × N × B × S (B = batch size, S = sequence length)

Computational distribution across architecture components

The transformer architecture distributes computation unevenly across its components. Attention mechanisms and feed-forward networks consume the majority of computational resources:

Computational Distribution:

Where S = sequence length and H = hidden dimension

For the largest models like GPT-4.5, attention mechanisms become increasingly dominant as context lengths extend to millions of tokens, despite comprising a smaller percentage of total parameters.

Understanding this distribution helps optimize hardware allocation and identify where performance improvements will yield the greatest benefits. With these computational requirements in mind, we can now explore how memory bandwidth addresses these demands.

Memory bandwidth and HBM technology advancements

Having established the computational requirements for LLMs, we must now consider the equally critical factor of memory bandwidth—often the true bottleneck in training and inference performance.

High Bandwidth Memory (HBM) technology has emerged as a critical solution for addressing the demanding memory requirements of large language models and AI workloads. As LLMs continue to grow in size and complexity, the need for enhanced memory solutions becomes increasingly essential for efficient inference.

Evolution of HBM technology

The progression from HBM2 to HBM3E represents significant advancements in meeting the computational demands of modern AI systems.

HBM3E Improvements:

  • Higher bandwidth capabilities
  • Increased memory capacity
  • Enhanced power efficiency over previous generations
  • Optimized stacked architecture

These improvements are particularly valuable for GPU acceleration of LLM workloads, where memory bandwidth often becomes the primary bottleneck.

Memory bottlenecks in LLM processing

LLM inference operations are predominantly memory-bandwidth-bound rather than compute-bound. This creates a unique challenge:

Memory Bottleneck Challenges:

  1. 1
    Matrix-matrix multiplication operations with small dimensions struggle with memory bandwidth constraints
  2. 2
    When generating tokens autoregressively, small batch sizes limit activation matrix dimensions
  3. 3
    Performance depends more on how quickly model parameters can be loaded from GPU memory to local caches
  4. 4
    Available memory bandwidth becomes a better predictor of token generation speed than raw compute performance

The compute versus memory barrier

Memory bandwidth is particularly crucial during the decoding phase of LLM inference:

Decoding Phase Characteristics:

  • Model Bandwidth Utilization (MBU) serves as a key metric for optimization
  • The speed of token generation depends heavily on efficient memory access patterns

Impact of batch size and context length

HBM3E's expanded capacity enables significant performance improvements for LLM inference:

Performance Factors:

  • Higher batch sizes require more HBM capacity but proportionally increase throughput
  • Larger context lengths require additional memory but are essential for complex tasks
  • Quantized models (such as INT4) can show up to 3x throughput improvement over FP16 models
  • HBM3E's higher capacity allows for larger context windows and batch sizes simultaneously

Memory bandwidth advancements, particularly through HBM3E technology, represent a crucial development in unlocking the full potential of large language models, significantly improving both inference speed and overall system efficiency. With this understanding of memory requirements, we can now examine how NVIDIA's Blackwell architecture incorporates these advances into its design.

NVIDIA Blackwell architecture: Technical specifications and performance

Building on our understanding of memory and computational requirements, let's examine NVIDIA's Blackwell architecture—the current state-of-the-art GPU designed specifically for AI workloads.

Breakthrough chiplet design

Blackwell's B200 GPU introduces a revolutionary chiplet-based architecture that delivers 4× the training throughput of previous H100 GPUs. This design splits the processor across multiple silicon dies, enabling higher yields and better performance scaling. The architecture employs high-bandwidth chip-to-chip connections to maintain data flow efficiency across these chiplet boundaries.

Each B200 GPU contains specialized tensor cores that significantly accelerate matrix operations critical for LLM workloads.

Transformer engine optimizations

The B200 features advanced transformer engines that automatically optimize precision formats for each layer of transformer models. This adaptive approach ensures maximum efficiency without sacrificing model quality.

Optimization Process:

  1. 1
    Analyze each transformer layer individually
  2. 2
    Select optimal numerical formats for each layer
  3. 3
    Balance computational efficiency with accuracy requirements
  4. 4
    Apply optimizations particularly for attention layers

These optimizations are particularly effective for attention layers, which typically consume significant computational resources during inference.

FP4 precision implementation

Blackwell introduces FP4 precision support, reducing memory requirements by 75% compared to BF16 formats. This implementation includes specialized hardware support for efficient 4-bit operations with minimal accuracy loss.

FP4 Benefits:

  • Reduces memory bandwidth needs while maintaining model quality
  • Allows larger context windows with the same memory footprint
  • Shows minimal accuracy loss for most LLM applications
  • Provides specialized hardware support for efficient 4-bit operations

Internal benchmarks show that FP4 reduces memory bandwidth needs while maintaining model quality for most LLM applications.

NVLink 5 and optical switching

The NVLink 5 interconnect provides 1.8TB/s bidirectional bandwidth between GPUs, dramatically improving multi-GPU communication efficiency. This high-speed fabric ensures near-linear scaling as models are distributed across multiple accelerators.

Optical circuit switching further enhances multi-node communication by reducing latency and increasing bandwidth for large-scale deployments.

Performance benchmarks

According to MLPerf data, the GB200 SuperPod delivers impressive performance metrics:

Blackwell Performance:

When running inference workloads, B200 GPUs achieve similar throughput advantages, particularly for large batch sizes where memory bandwidth typically becomes a bottleneck in previous-generation hardware. With these capabilities, Blackwell sets new standards for LLM training performance, though maximizing its potential requires advanced parallelism techniques.

Advanced parallelism techniques for distributed training

As we've seen with Blackwell's architecture, modern GPU hardware offers tremendous computational power. However, efficiently utilizing this power for the largest models requires sophisticated parallelism approaches.

Data, tensor, and pipeline parallelism implementation

Parallelism Approaches Comparison:

Each parallelism technique serves different purposes. While data parallelism improves throughput without affecting latency, tensor parallelism reduces latency but requires high-bandwidth GPU interconnects to minimize communication overhead.

3D/5D parallelism for trillion-parameter models

Advanced models use combined parallelism strategies:

Advanced Parallelism Strategies:

  1. 1

    3D Parallelism

    Integrates data, tensor, and pipeline approaches for effective scaling
  2. 2

    Sequence Parallelism

    Partitions operations like LayerNorm and Dropout along the sequence dimension
  3. 3

    Fully Sharded Data Parallelism

    Distributes model parameters, optimizer states, and gradients across devices

For trillion-parameter models, sequence parallelism further enhances efficiency. Parameters are fetched from shards as needed, used for computation, then discarded, dramatically reducing memory requirements.

Scaling efficiency across parallelism strategies

The efficiency of different parallelism approaches varies significantly based on model size and available hardware.

Parallelism Efficiency by Model Size

Smaller models (e.g., Llama3-8B):

  • Tensor parallelism: Minimal benefits at low request concurrency
  • Becomes advantageous when latency requirements are strict (below 7ms per token)

Larger models (e.g., Llama3-70B):

  • Tensor parallelism shows more substantial benefits
  • All strategies face diminishing returns as scale increases

Scaling Performance:

  • Doubling from 4 to 8 GPUs typically yields only a 0.7x decrease in latency
  • Increased communication overhead is the primary limiting factor

Minimizing communication bottlenecks

Communication patterns significantly impact performance in multi-node GPU environments.

Hardware Topology Considerations:

  • Some 8xA100 instances: Uniform high-bandwidth connections between all GPUs
  • Other configurations: Lower-bandwidth connections between GPU pairs

Optimization Strategies:

  1. 1
    Use topology-aware compilers like TensorRT-LLM to partition models effectively
  2. 2
    Keep high-bandwidth tensor parallel operations within a single server
  3. 3
    Leverage architectures like Grace-Hopper with 900GBps NVlinks for efficient parameter streaming

Understanding these hardware details is essential when implementing parallelism strategies, as real-world performance can deviate significantly from theoretical expectations if communication patterns aren't optimized for the underlying hardware topology.

Conclusion

Efficient GPU utilization represents one of the most significant opportunities for AI teams to gain competitive advantage. The architecture fundamentals covered—from streaming multiprocessors to memory hierarchies—directly impact your ability to train larger models faster and at lower cost.

Critical Takeaways:

  • Understand the memory-bound nature of inference
  • Leverage advanced parallelism techniques appropriately for your model size
  • Recognize when to prioritize bandwidth over raw compute power

NVIDIA's Blackwell architecture with FP4 precision and improved memory bandwidth establishes new performance benchmarks, but requires thoughtful implementation to realize its full potential.

Recommendations for Teams:

For product teams, these insights should inform infrastructure planning and development timelines. Engineers should focus on memory optimization techniques and parallelism strategies aligned with specific model requirements. Leadership teams can use this knowledge to make more informed investment decisions in AI hardware—balancing immediate performance needs with long-term scalability. As models continue growing in size and complexity, your team's expertise in GPU architecture will become an increasingly valuable asset.

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