diff --git a/Cargo.toml b/Cargo.toml index df4fc6f31e80f79f0529f925e3d675fb0059902f..66db77692daeb7433c68eee71190704a61221d51 100644 --- a/Cargo.toml +++ b/Cargo.toml @@ -44,7 +44,7 @@ fuzzy-matcher = "0.3.7" #rust_libecpint = {path="../rust_libecpint"} # seems to pull in libssl and libcrypto which is rejected by manylinux reqwest = { version = "0.10", default-features = false, features = ["blocking", "json", "rustls-tls"] } -mpi = {version = "0.8.0", features = ["user-operations", "derive"], optional = true} +mpi = {version = "0.8", features = ["user-operations", "derive"], optional = true} # for cuda #cudarc = "0.10.0" rest_tensors = {path="../rest_tensors"} diff --git a/src/scf_io/mod.rs b/src/scf_io/mod.rs index 5b97d7f41ff5874572c94ebd44c3b25028646163..faeeeba761449f055d78f2e8c09199e4d4f7c30d 100644 --- a/src/scf_io/mod.rs +++ b/src/scf_io/mod.rs @@ -47,6 +47,9 @@ use self::util::norm; use smear::apply_smearing; use smear::annealed_sigma; +#[allow(unused_imports)] +use tensors::BasicMatUp; + #[pyclass] #[derive(Clone)] pub struct SCF {