This python package, based on PySCF, provides the semiempirical TDDFT-ris method, offering a quick and accurate calculation of TDDFT UV-vis absorption spectra. The TDDFT-ris calculation starts from a ...
This repository contains pre-built examples to help customers get started with the Amazon Bedrock service. { "Version": "2012-10-17", "Statement": [ { "Sid ...
Abstract: Many physical processes display complex high-dimensional time-varying behavior, from global weather patterns to brain activity. An outstanding challenge is to express high dimensional data ...