MRMD
0.4.0
Multi Resolution Molecular Dynamics
Loading...
Searching...
No Matches
SystemMomentum.hpp
Go to the documentation of this file.
1
// Copyright 2024 Sebastian Eibl
2
//
3
// Licensed under the Apache License, Version 2.0 (the "License");
4
// you may not use this file except in compliance with the License.
5
// You may obtain a copy of the License at
6
//
7
// https://www.apache.org/licenses/LICENSE-2.0
8
//
9
// Unless required by applicable law or agreed to in writing, software
10
// distributed under the License is distributed on an "AS IS" BASIS,
11
// WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
12
// See the License for the specific language governing permissions and
13
// limitations under the License.
14
15
#pragma once
16
17
#include "
data/Atoms.hpp
"
18
19
namespace
mrmd
20
{
21
namespace
analysis
22
{
23
Vector3D
getSystemMomentum
(
data::Atoms
& atoms);
24
25
}
// namespace analysis
26
}
// namespace mrmd
Atoms.hpp
mrmd::analysis::getSystemMomentum
Vector3D getSystemMomentum(data::Atoms &atoms)
Definition
SystemMomentum.cpp:21
mrmd::data::Atoms
DeviceAtoms Atoms
Definition
Atoms.hpp:177
mrmd
Definition
BerendsenBarostat.cpp:18
mrmd::Vector3D
Kokkos::Array< real_t, 3 > Vector3D
Definition
datatypes.hpp:101
mrmd
analysis
SystemMomentum.hpp
Generated by
1.9.8