Scientific capabilities and deployment sustainability of small-scale LLMs in biological wastewater treatment

Abstract: LLMs are emerging as scientific assistants, yet their computational demands and limited domain specialization constrain sustainable deployment in environmental engineering. Here, we investigate whether domain-specialized small-scale LLMs can combine scientific capability with sustainable deployment in biological wastewater treatment. We developed a benchmark evaluating three scientific capabilities of LLMs: retrospective cognition, comprehension fidelity, and prospective extrapolation. BioWater (8 billion parameters, fine-tuned on specialized domain knowledge) achieved higher comprehension-fidelity scores than participating human experts and performance comparable to a 397-billion-parameter general-purpose LLM in retrospective cognition and prospective extrapolation. Human-BioWater collaboration generated a scientific hypothesis that was subsequently supported by laboratory experiments, demonstrating its potential to contribute to prospective scientific research. We further evaluated the economic and environmental implications of LLM deployment across global wastewater treatment plants (WWTPs). Locally deployed small-scale LLMs became more sustainable than cloud-based large-scale LLMs as inference demand increased in intelligent WWTPs. These findings highlight domain-specialized small-scale LLMs as a promising pathway towards scientifically capable, computationally efficient, and sustainably deployable artificial intelligence for wastewater treatment.