Paul Duncan

h-index22
2papers

2 Papers

CYMay 24, 2025
Reality Check: A New Evaluation Ecosystem Is Necessary to Understand AI's Real World Effects

Reva Schwartz, Rumman Chowdhury, Akash Kundu et al.

Conventional AI evaluation approaches concentrated within the AI stack exhibit systemic limitations for exploring, navigating and resolving the human and societal factors that play out in real world deployment such as in education, finance, healthcare, and employment sectors. AI capability evaluations can capture detail about first-order effects, such as whether immediate system outputs are accurate, or contain toxic, biased or stereotypical content, but AI's second-order effects, i.e. any long-term outcomes and consequences that may result from AI use in the real world, have become a significant area of interest as the technology becomes embedded in our daily lives. These secondary effects can include shifts in user behavior, societal, cultural and economic ramifications, workforce transformations, and long-term downstream impacts that may result from a broad and growing set of risks. This position paper argues that measuring the indirect and secondary effects of AI will require expansion beyond static, single-turn approaches conducted in silico to include testing paradigms that can capture what actually materializes when people use AI technology in context. Specifically, we describe the need for data and methods that can facilitate contextual awareness and enable downstream interpretation and decision making about AI's secondary effects, and recommend requirements for a new ecosystem.

CHEM-PHApr 4, 2014
Understanding Machine-learned Density Functionals

Li Li, John C. Snyder, Isabelle M. Pelaschier et al.

Kernel ridge regression is used to approximate the kinetic energy of non-interacting fermions in a one-dimensional box as a functional of their density. The properties of different kernels and methods of cross-validation are explored, and highly accurate energies are achieved. Accurate {\em constrained optimal densities} are found via a modified Euler-Lagrange constrained minimization of the total energy. A projected gradient descent algorithm is derived using local principal component analysis. Additionally, a sparse grid representation of the density can be used without degrading the performance of the methods. The implications for machine-learned density functional approximations are discussed.