libcint 0.2.0

FFI binding and GTO wrapper for libcint (C library)
Documentation
[dependencies.derive_builder]
version = "0.20"

[dependencies.duplicate]
version = "2.0"

[dependencies.itertools]
version = "0.14"

[dependencies.libcint-src]
version = "0.2.0"

[dependencies.libm]
version = "0.2"

[dependencies.num]
features = ["std"]
version = "0.4"

[dependencies.rayon]
version = "1.10"

[dependencies.rstsr-common]
features = ["rayon"]
version = "0.6"

[dependencies.serde]
features = ["derive"]
version = "1.0"

[dependencies.serde_json]
version = "1.0"

[dev-dependencies.approx]
version = "0.5"

[dev-dependencies.rstest]
version = "0.25"

[features]
build_from_source = ["libcint-src/build_from_source"]
default = []
qcint = ["libcint-src/qcint"]
static = ["libcint-src/static"]
with_4c1e = ["libcint-src/with_4c1e"]
with_f12 = ["libcint-src/with_f12"]

[lib]
name = "libcint"
path = "src/lib.rs"

[package]
autobenches = false
autobins = false
autoexamples = false
autolib = false
autotests = false
build = "build.rs"
categories = ["science"]
description = "FFI binding and GTO wrapper for libcint (C library)"
edition = "2021"
keywords = ["chemistry", "integral", "scientific"]
license = "Apache-2.0"
name = "libcint"
readme = "readme.md"
repository = "https://github.com/ajz34/libcint-rs"
rust-version = "1.82.0"
version = "0.2.0"

[package.metadata.docs.rs]
features = ["default"]
rustdoc-args = ["--cfg", "docsrs", "--document-private-items", "--html-in-header", "katex-header.html"]

[[test]]
name = "gto_c10h22_qzvp"
path = "tests/gto_c10h22_qzvp.rs"

[[test]]
name = "gto_sb2me4_pvtz"
path = "tests/gto_sb2me4_pvtz.rs"

[[test]]
name = "intor_grids"
path = "tests/intor_grids.rs"

[[test]]
name = "intor_h2o_tzvp"
path = "tests/intor_h2o_tzvp.rs"

[[test]]
name = "intor_h2o_tzvp_row_major"
path = "tests/intor_h2o_tzvp_row_major.rs"

[[test]]
name = "intor_sb2me4"
path = "tests/intor_sb2me4.rs"

[[test]]
name = "special_change"
path = "tests/special_change.rs"

[[test]]
name = "special_na_ecpso"
path = "tests/special_na_ecpso.rs"