1.7K Star 2.7K Fork 4.1K

GVPMindSpore/mindquantum

加入 Gitee
与超过 1200万 开发者一起发现、参与优秀开源项目,私有仓库也完全免费 :)
免费加入
文件
克隆/下载
qubit_hamiltonian.py 1.21 KB
一键复制 编辑 原始数据 按行查看 历史
donghufeng 提交于 2023-10-10 23:24 . compress hamiltonian
# Copyright 2021 Huawei Technologies Co., Ltd
#
# Licensed under the Apache License, Version 2.0 (the "License");
# you may not use this file except in compliance with the License.
# You may obtain a copy of the License at
#
# http://www.apache.org/licenses/LICENSE-2.0
#
# Unless required by applicable law or agreed to in writing, software
# distributed under the License is distributed on an "AS IS" BASIS,
# WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
# See the License for the specific language governing permissions and
# limitations under the License.
# ============================================================================
"""Get qubit hamiltonian."""
from mindquantum.core.operators import FermionOperator, InteractionOperator
from .transform import Transform
def get_qubit_hamiltonian(mol):
r"""
Get the qubit hamiltonian of a molecular data.
Args:
mol (MolecularData): molecular data.
Returns:
QubitOperator, qubit operator of this molecular.
"""
m_ham = mol.get_molecular_hamiltonian()
int_ham = InteractionOperator(*(m_ham.n_body_tensors.values()))
f_ham = FermionOperator(int_ham).compress()
return Transform(f_ham).jordan_wigner()
Loading...
马建仓 AI 助手
尝试更多
代码解读
代码找茬
代码优化
Python
1
https://gitee.com/mindspore/mindquantum.git
git@gitee.com:mindspore/mindquantum.git
mindspore
mindquantum
mindquantum
r0.9

搜索帮助

0d507c66 1850385 C8b1a773 1850385