From 9a458b5a33351c93a8c0b9b2d1e76d2d2b8b14df Mon Sep 17 00:00:00 2001 From: "puzhichen.996" Date: Mon, 20 Jan 2025 17:17:00 +0800 Subject: [PATCH] change some codes --- gpu4pyscf/grad/tdrhf.py | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/gpu4pyscf/grad/tdrhf.py b/gpu4pyscf/grad/tdrhf.py index 20599aac..3c9d3f56 100644 --- a/gpu4pyscf/grad/tdrhf.py +++ b/gpu4pyscf/grad/tdrhf.py @@ -20,8 +20,8 @@ from pyscf import lib from pyscf.lib import logger from gpu4pyscf.grad import rhf as rhf_grad -from gpu4pyscf.df import int3c2e #TODO: move int3c2e to out of df -from gpu4pyscf.lib.cupy_helper import tag_array, contract, condense, sandwich_dot, reduce_to_device +from gpu4pyscf.df import int3c2e +from gpu4pyscf.lib.cupy_helper import contract from gpu4pyscf.scf import cphf from gpu4pyscf import lib as lib_gpu from pyscf import __config__