Abstract:We propose a variational autoencoder (VAE)-based model for building forward and inverse structure-property linkages, a problem of paramount importance in computational materials science. Our model systematically combines VAE with regression, linking the two models through a two-level prior conditioned on the regression variables. The regression loss is optimized jointly with the reconstruction loss of the variational autoencoder, learning microstructure features relevant for property prediction and reconstruction. The resultant model can be used for both forward and inverse prediction i.e., for predicting the properties of a given microstructure as well as for predicting the microstructure required to obtain given properties. Since the inverse problem is ill-posed (one-to-many), we derive the objective function using a multi-modal Gaussian mixture prior enabling the model to infer multiple microstructures for a target set of properties. We show that for forward prediction, our model is as accurate as state-of-the-art forward-only models. Additionally, our method enables direct inverse inference. We show that the microstructures inferred using our model achieve desired properties reasonably accurately, avoiding the need for expensive optimization loops.
Abstract:We present a novel retrofitting method to induce emotion aspects into pre-trained language models (PLMs) such as BERT and RoBERTa. Our method updates pre-trained network weights using contrastive learning so that the text fragments exhibiting similar emotions are encoded nearby in the representation space, and the fragments with different emotion content are pushed apart. While doing so, it also ensures that the linguistic knowledge already present in PLMs is not inadvertently perturbed. The language models retrofitted by our method, i.e., BERTEmo and RoBERTaEmo, produce emotion-aware text representations, as evaluated through different clustering and retrieval metrics. For the downstream tasks on sentiment analysis and sarcasm detection, they perform better than their pre-trained counterparts (about 1% improvement in F1-score) and other existing approaches. Additionally, a more significant boost in performance is observed for the retrofitted models over pre-trained ones in few-shot learning setting.