We have noticed an unexpected behavior of CUDA compilation on Blackwell cards (sm_100 and sm_120). The ECP type 2 general kernel, as well as general first and second derivative kernels for both ECP ...
import numpy as np from pyscf.pbc import gto, scf atom = ''' Cu 0.0 0.0 0.0 Cu 0.0 , 1.8075, 1.8075 Cu 1.8075 , 0.0, 1.8075 Cu 1.8075 , 1.8075, 0.0 ''' a = np.eye(3) * 3.615 cell = gto.Cell(atom=atom, ...
COPING behaviors that temporarily alleviate the distressing sensations of oral cenesthopathy are linked to paradoxical changes in brain perfusion, according to new neuroimaging research. The study ...