From ecaef1daf82fe1c448cd89fd0b5143b5e5742d30 Mon Sep 17 00:00:00 2001 From: kylebystrom Date: Mon, 13 May 2024 17:14:07 -0400 Subject: [PATCH] fix import in analyzers --- ciderpress/pyscf/analyzers.py | 3 ++- 1 file changed, 2 insertions(+), 1 deletion(-) diff --git a/ciderpress/pyscf/analyzers.py b/ciderpress/pyscf/analyzers.py index 532eff8..624883c 100644 --- a/ciderpress/pyscf/analyzers.py +++ b/ciderpress/pyscf/analyzers.py @@ -3,8 +3,9 @@ import numpy as np from pyscf import dft, gto, lib, scf from pyscf.dft.gen_grid import Grids +from pyscf.sgx.sgx import sgx_fit -from ciderpress.external.sgx_tools import get_jk_densities, sgx_fit +from ciderpress.external.sgx_tools import get_jk_densities CALC_TYPES = { "RHF": scf.hf.RHF,