From 08739bc34217f101e1529c4f2b2563ce0808e87a Mon Sep 17 00:00:00 2001 From: = Date: Wed, 18 Oct 2023 09:11:16 +0800 Subject: [PATCH] Downgrading pyscf, pyscf 2.4.0 does not support macos --- poetry.lock | 30 +++++++++++++++++++++--------- pyproject.toml | 2 +- 2 files changed, 22 insertions(+), 10 deletions(-) diff --git a/poetry.lock b/poetry.lock index a9be0d8..f729f1b 100644 --- a/poetry.lock +++ b/poetry.lock @@ -2168,21 +2168,33 @@ diagrams = ["jinja2", "railroad-diagrams"] [[package]] name = "pyscf" -version = "2.4.0" +version = "2.3.0" description = "PySCF: Python-based Simulations of Chemistry Framework" optional = false python-versions = "*" files = [ - {file = "pyscf-2.4.0-py3-none-manylinux_2_17_aarch64.manylinux2014_aarch64.whl", hash = "sha256:8c9de88f339e18a0c6292633556c0822ef0ca29692a5642b8bc0bae2c8465939"}, - {file = "pyscf-2.4.0-py3-none-manylinux_2_17_x86_64.manylinux2014_x86_64.whl", hash = "sha256:be8a4240fde06e6ed3a8092969fa71a55c3ad4895b30eb65663d0388af4ce441"}, - 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{file = "urllib3-2.0.6-py3-none-any.whl", hash = "sha256:7a7c7003b000adf9e7ca2a377c9688bbc54ed41b985789ed576570342a375cd2"}, - {file = "urllib3-2.0.6.tar.gz", hash = "sha256:b19e1a85d206b56d7df1d5e683df4a7725252a964e3993648dd0fb5a1c157564"}, + {file = "urllib3-2.0.7-py3-none-any.whl", hash = "sha256:fdb6d215c776278489906c2f8916e6e7d4f5a9b602ccbcfdf7f016fc8da0596e"}, + {file = "urllib3-2.0.7.tar.gz", hash = "sha256:c97dfde1f7bd43a71c8d2a58e369e9b2bf692d1334ea9f9cae55add7d0dd0f84"}, ] [package.extras] @@ -3219,4 +3231,4 @@ testing = ["big-O", "jaraco.functools", "jaraco.itertools", "more-itertools", "p [metadata] lock-version = "2.0" python-versions = ">3.9,<3.12" -content-hash = "0f0402930870f7ab81b3e6dbebc909d37e3f978a7f14fca5314a170afa152269" +content-hash = "daaec47b6fd43839f958f5021892900649c5eccc34157dc71d4a07c8a0d1ac83" diff --git a/pyproject.toml b/pyproject.toml index c95a0e5..7b40d51 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -18,7 +18,7 @@ packages = [{ include = "qibochem", from = "src" }] python = ">3.9,<3.12" qibo = ">=0.1.10" openfermion = "^1.5" -pyscf = "^2.3.0" +pyscf = "2.3.0" scipy = "^1.10.1" furo = "^2023.09.10"