Update Kokkos library in LAMMPS to v4.0
This commit is contained in:
Stan Gerald Moore
@ -1,46 +1,18 @@
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/*
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//@HEADER
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// ************************************************************************
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//
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// Kokkos v. 3.0
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// Copyright (2020) National Technology & Engineering
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// Kokkos v. 4.0
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// Copyright (2022) National Technology & Engineering
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// Solutions of Sandia, LLC (NTESS).
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//
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// Under the terms of Contract DE-NA0003525 with NTESS,
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// the U.S. Government retains certain rights in this software.
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//
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// Redistribution and use in source and binary forms, with or without
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// modification, are permitted provided that the following conditions are
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// met:
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// Part of Kokkos, under the Apache License v2.0 with LLVM Exceptions.
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// See https://kokkos.org/LICENSE for license information.
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// SPDX-License-Identifier: Apache-2.0 WITH LLVM-exception
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//
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// 1. Redistributions of source code must retain the above copyright
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// notice, this list of conditions and the following disclaimer.
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//
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// 2. Redistributions in binary form must reproduce the above copyright
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// notice, this list of conditions and the following disclaimer in the
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// documentation and/or other materials provided with the distribution.
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//
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// 3. Neither the name of the Corporation nor the names of the
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// contributors may be used to endorse or promote products derived from
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// this software without specific prior written permission.
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//
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// THIS SOFTWARE IS PROVIDED BY NTESS "AS IS" AND ANY
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// EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE
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// IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR
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// PURPOSE ARE DISCLAIMED. IN NO EVENT SHALL NTESS OR THE
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// CONTRIBUTORS BE LIABLE FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL,
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// EXEMPLARY, OR CONSEQUENTIAL DAMAGES (INCLUDING, BUT NOT LIMITED TO,
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// PROCUREMENT OF SUBSTITUTE GOODS OR SERVICES; LOSS OF USE, DATA, OR
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// PROFITS; OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON ANY THEORY OF
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// LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT (INCLUDING
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// NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS
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// SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
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//
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// Questions? Contact Christian R. Trott (crtrott@sandia.gov)
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//
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// ************************************************************************
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//@HEADER
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*/
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#ifndef KOKKOS_MACROS_HPP
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#define KOKKOS_MACROS_HPP
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@ -54,13 +26,33 @@
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* KOKKOS_ENABLE_OPENMP Kokkos::OpenMP execution space
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* KOKKOS_ENABLE_OPENMPTARGET Kokkos::Experimental::OpenMPTarget
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* execution space
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* KOKKOS_ENABLE_HIP Kokkos::Experimental::HIP execution space
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* KOKKOS_ENABLE_HIP Kokkos::HIP execution space
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* KOKKOS_ENABLE_SYCL Kokkos::Experimental::SYCL execution space
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* KOKKOS_ENABLE_HWLOC HWLOC library is available.
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* KOKKOS_ENABLE_DEBUG_BOUNDS_CHECK Insert array bounds checks, is expensive!
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* KOKKOS_ENABLE_CUDA_UVM Use CUDA UVM for Cuda memory space.
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*/
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#define KOKKOS_VERSION_LESS(MAJOR, MINOR, PATCH) \
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(KOKKOS_VERSION < ((MAJOR)*10000 + (MINOR)*100 + (PATCH)))
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#define KOKKOS_VERSION_LESS_EQUAL(MAJOR, MINOR, PATCH) \
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(KOKKOS_VERSION <= ((MAJOR)*10000 + (MINOR)*100 + (PATCH)))
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#define KOKKOS_VERSION_GREATER(MAJOR, MINOR, PATCH) \
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(KOKKOS_VERSION > ((MAJOR)*10000 + (MINOR)*100 + (PATCH)))
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#define KOKKOS_VERSION_GREATER_EQUAL(MAJOR, MINOR, PATCH) \
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(KOKKOS_VERSION >= ((MAJOR)*10000 + (MINOR)*100 + (PATCH)))
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#define KOKKOS_VERSION_EQUAL(MAJOR, MINOR, PATCH) \
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(KOKKOS_VERSION == ((MAJOR)*10000 + (MINOR)*100 + (PATCH)))
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#if !KOKKOS_VERSION_EQUAL(KOKKOS_VERSION_MAJOR, KOKKOS_VERSION_MINOR, \
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KOKKOS_VERSION_PATCH)
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#error implementation bug
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#endif
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#ifndef KOKKOS_DONT_INCLUDE_CORE_CONFIG_H
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#include <KokkosCore_config.h>
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#endif
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@ -73,11 +65,10 @@
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* KOKKOS_COMPILER_NVCC
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* KOKKOS_COMPILER_GNU
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* KOKKOS_COMPILER_INTEL
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* KOKKOS_COMPILER_IBM
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* KOKKOS_COMPILER_CRAYC
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* KOKKOS_COMPILER_APPLECC
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* KOKKOS_COMPILER_CLANG
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* KOKKOS_COMPILER_PGI
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* KOKKOS_COMPILER_NVHPC
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* KOKKOS_COMPILER_MSVC
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*
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* Macros for which compiler extension to use for atomics on intrinsic types
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@ -117,15 +108,18 @@
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// Code is parsed and separated into host and device code.
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// Host code is compiled again with another compiler.
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// Device code is compile to 'ptx'.
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#define KOKKOS_COMPILER_NVCC __NVCC__
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// NOTE: There is no __CUDACC_VER_PATCH__ officially, its __CUDACC_VER_BUILD__
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// which does have more than one digit (potentially undefined number of them).
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// This macro definition is in line with our other compiler defs
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#define KOKKOS_COMPILER_NVCC \
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__CUDACC_VER_MAJOR__ * 100 + __CUDACC_VER_MINOR__ * 10
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#endif // #if defined( __NVCC__ )
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#if !defined(KOKKOS_LAMBDA)
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#define KOKKOS_LAMBDA [=]
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#endif
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#if (defined(KOKKOS_ENABLE_CXX17) || defined(KOKKOS_ENABLE_CXX20)) && \
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!defined(KOKKOS_CLASS_LAMBDA)
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#if !defined(KOKKOS_CLASS_LAMBDA)
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#define KOKKOS_CLASS_LAMBDA [ =, *this ]
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#endif
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@ -150,21 +144,11 @@
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#define KOKKOS_COMPILER_CRAYC _CRAYC
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#endif
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#if defined(__IBMCPP__)
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// IBM C++
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#define KOKKOS_COMPILER_IBM __IBMCPP__
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#elif defined(__IBMC__)
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#define KOKKOS_COMPILER_IBM __IBMC__
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#elif defined(__ibmxl_vrm__) // xlclang++
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#define KOKKOS_COMPILER_IBM __ibmxl_vrm__
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#endif
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#if defined(__APPLE_CC__)
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#define KOKKOS_COMPILER_APPLECC __APPLE_CC__
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#endif
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#if defined(__clang__) && !defined(KOKKOS_COMPILER_INTEL) && \
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!defined(KOKKOS_COMPILER_IBM)
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#if defined(__clang__) && !defined(KOKKOS_COMPILER_INTEL)
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#define KOKKOS_COMPILER_CLANG \
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__clang_major__ * 100 + __clang_minor__ * 10 + __clang_patchlevel__
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#endif
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@ -178,15 +162,6 @@
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#endif
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#endif
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#if defined(__PGIC__)
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#define KOKKOS_COMPILER_PGI \
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__PGIC__ * 100 + __PGIC_MINOR__ * 10 + __PGIC_PATCHLEVEL__
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#if (1740 > KOKKOS_COMPILER_PGI)
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#error "Compiling with PGI version earlier than 17.4 is not supported."
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#endif
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#endif
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#if defined(__NVCOMPILER)
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#define KOKKOS_COMPILER_NVHPC \
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__NVCOMPILER_MAJOR__ * 100 + __NVCOMPILER_MINOR__ * 10 + \
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@ -204,16 +179,6 @@
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// of the supported OpenMP API version.
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#endif // #if defined( _OPENMP )
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#if defined(KOKKOS_ENABLE_CXX17)
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#define KOKKOS_IMPL_FALLTHROUGH [[fallthrough]];
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#elif defined(KOKKOS_COMPILER_GNU) && (KOKKOS_COMPILER_GNU >= 710)
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#define KOKKOS_IMPL_FALLTHROUGH [[gnu::fallthrough]];
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#elif defined(KOKKOS_COMPILER_CLANG)
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#define KOKKOS_IMPL_FALLTHROUGH [[clang::fallthrough]];
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#else
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#define KOKKOS_IMPL_FALLTHROUGH
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#endif
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//----------------------------------------------------------------------------
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// Intel compiler macros
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@ -224,14 +189,6 @@
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#define KOKKOS_ENABLE_PRAGMA_LOOPCOUNT 1
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#define KOKKOS_ENABLE_PRAGMA_VECTOR 1
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#endif
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#if (1800 > KOKKOS_COMPILER_INTEL)
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#define KOKKOS_ENABLE_PRAGMA_SIMD 1
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#endif
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// FIXME Workaround for ICE with intel 17,18,19,20,21 in Trilinos
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#if (KOKKOS_COMPILER_INTEL <= 2100)
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#define KOKKOS_IMPL_WORKAROUND_ICE_IN_TRILINOS_WITH_OLD_INTEL_COMPILERS
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#endif
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// FIXME_SYCL
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#if !defined(KOKKOS_ENABLE_SYCL)
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@ -256,8 +213,8 @@
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#endif
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#endif
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#if (1700 > KOKKOS_COMPILER_INTEL)
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#error "Compiling with Intel version earlier than 17.0 is not supported."
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#if (1900 > KOKKOS_COMPILER_INTEL)
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#error "Compiling with Intel version earlier than 19.0.5 is not supported."
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#endif
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#if !defined(KOKKOS_ENABLE_ASM) && !defined(_WIN32)
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@ -276,13 +233,6 @@
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#if defined(KOKKOS_ARCH_AVX512MIC)
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#define KOKKOS_ENABLE_RFO_PREFETCH 1
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#if (KOKKOS_COMPILER_INTEL < 1800) && !defined(KOKKOS_KNL_USE_ASM_WORKAROUND)
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#define KOKKOS_KNL_USE_ASM_WORKAROUND 1
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#endif
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#endif
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#if (1800 > KOKKOS_COMPILER_INTEL)
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#define KOKKOS_IMPL_INTEL_WORKAROUND_NOEXCEPT_SPECIFICATION_VIRTUAL_FUNCTION
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#endif
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#if defined(__MIC__)
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@ -296,21 +246,6 @@
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#if defined(KOKKOS_COMPILER_CRAYC)
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#endif
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//----------------------------------------------------------------------------
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// IBM Compiler macros
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#if defined(KOKKOS_COMPILER_IBM)
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#define KOKKOS_ENABLE_PRAGMA_UNROLL 1
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//#define KOKKOS_ENABLE_PRAGMA_IVDEP 1
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//#define KOKKOS_ENABLE_PRAGMA_LOOPCOUNT 1
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//#define KOKKOS_ENABLE_PRAGMA_VECTOR 1
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//#define KOKKOS_ENABLE_PRAGMA_SIMD 1
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#if !defined(KOKKOS_ENABLE_ASM)
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#define KOKKOS_ENABLE_ASM 1
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#endif
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#endif
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//----------------------------------------------------------------------------
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// CLANG compiler macros
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@ -319,7 +254,6 @@
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//#define KOKKOS_ENABLE_PRAGMA_IVDEP 1
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//#define KOKKOS_ENABLE_PRAGMA_LOOPCOUNT 1
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//#define KOKKOS_ENABLE_PRAGMA_VECTOR 1
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//#define KOKKOS_ENABLE_PRAGMA_SIMD 1
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#if !defined(KOKKOS_IMPL_HOST_FORCEINLINE_FUNCTION)
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#define KOKKOS_IMPL_HOST_FORCEINLINE_FUNCTION \
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@ -341,7 +275,6 @@
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//#define KOKKOS_ENABLE_PRAGMA_IVDEP 1
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//#define KOKKOS_ENABLE_PRAGMA_LOOPCOUNT 1
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//#define KOKKOS_ENABLE_PRAGMA_VECTOR 1
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//#define KOKKOS_ENABLE_PRAGMA_SIMD 1
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#if defined(KOKKOS_ARCH_AVX512MIC)
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#define KOKKOS_ENABLE_RFO_PREFETCH 1
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@ -369,7 +302,6 @@
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#define KOKKOS_ENABLE_PRAGMA_IVDEP 1
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//#define KOKKOS_ENABLE_PRAGMA_LOOPCOUNT 1
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#define KOKKOS_ENABLE_PRAGMA_VECTOR 1
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//#define KOKKOS_ENABLE_PRAGMA_SIMD 1
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#endif
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//----------------------------------------------------------------------------
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@ -408,11 +340,11 @@
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#endif
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#if !defined(KOKKOS_INLINE_FUNCTION_DELETED)
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#define KOKKOS_INLINE_FUNCTION_DELETED inline
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#define KOKKOS_INLINE_FUNCTION_DELETED
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#endif
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#if !defined(KOKKOS_DEFAULTED_FUNCTION)
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#define KOKKOS_DEFAULTED_FUNCTION inline
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#define KOKKOS_DEFAULTED_FUNCTION
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#endif
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#if !defined(KOKKOS_IMPL_HOST_FUNCTION)
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@ -476,6 +408,7 @@
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#if 1 < ((defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_CUDA) ? 1 : 0) + \
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(defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_HIP) ? 1 : 0) + \
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(defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_SYCL) ? 1 : 0) + \
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(defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_OPENACC) ? 1 : 0) + \
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(defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_OPENMPTARGET) ? 1 : 0) + \
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(defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_OPENMP) ? 1 : 0) + \
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(defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_THREADS) ? 1 : 0) + \
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@ -485,10 +418,12 @@
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#endif
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// If default is not specified then chose from enabled execution spaces.
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// Priority: CUDA, HIP, SYCL, OPENMPTARGET, OPENMP, THREADS, HPX, SERIAL
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// Priority: CUDA, HIP, SYCL, OPENACC, OPENMPTARGET, OPENMP, THREADS, HPX,
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// SERIAL
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#if defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_CUDA)
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#elif defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_HIP)
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#elif defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_SYCL)
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#elif defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_OPENACC)
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#elif defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_OPENMPTARGET)
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#elif defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_OPENMP)
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#elif defined(KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_THREADS)
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@ -500,6 +435,8 @@
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#define KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_HIP
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#elif defined(KOKKOS_ENABLE_SYCL)
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#define KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_SYCL
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#elif defined(KOKKOS_ENABLE_OPENACC)
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#define KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_OPENACC
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#elif defined(KOKKOS_ENABLE_OPENMPTARGET)
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#define KOKKOS_ENABLE_DEFAULT_DEVICE_TYPE_OPENMPTARGET
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#elif defined(KOKKOS_ENABLE_OPENMP)
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@ -514,6 +451,7 @@
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//----------------------------------------------------------------------------
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// Determine for what space the code is being compiled:
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#if defined(KOKKOS_ENABLE_DEPRECATED_CODE_3)
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#if defined(__CUDACC__) && defined(__CUDA_ARCH__) && defined(KOKKOS_ENABLE_CUDA)
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#define KOKKOS_ACTIVE_EXECUTION_MEMORY_SPACE_CUDA
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@ -526,6 +464,7 @@
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#define KOKKOS_ACTIVE_EXECUTION_MEMORY_SPACE_HOST
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#endif
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#endif
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//----------------------------------------------------------------------------
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// Remove surrounding parentheses if present
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@ -574,6 +513,29 @@ static constexpr bool kokkos_omp_on_host() { return false; }
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#endif
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#endif
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#ifdef KOKKOS_ENABLE_OPENACC
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#ifdef KOKKOS_COMPILER_NVHPC
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#define KOKKOS_IF_ON_DEVICE(CODE) \
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if (__builtin_is_device_code()) { \
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KOKKOS_IMPL_STRIP_PARENS(CODE) \
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}
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#define KOKKOS_IF_ON_HOST(CODE) \
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if (!__builtin_is_device_code()) { \
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KOKKOS_IMPL_STRIP_PARENS(CODE) \
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}
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#else
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// FIXME_OPENACC acc_on_device is a non-constexpr function
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#define KOKKOS_IF_ON_DEVICE(CODE) \
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if constexpr (acc_on_device(acc_device_not_host)) { \
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KOKKOS_IMPL_STRIP_PARENS(CODE) \
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}
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#define KOKKOS_IF_ON_HOST(CODE) \
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if constexpr (acc_on_device(acc_device_host)) { \
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KOKKOS_IMPL_STRIP_PARENS(CODE) \
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}
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||||
#endif
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#endif
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#if !defined(KOKKOS_IF_ON_HOST) && !defined(KOKKOS_IF_ON_DEVICE)
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#if (defined(KOKKOS_ENABLE_CUDA) && defined(__CUDA_ARCH__)) || \
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(defined(KOKKOS_ENABLE_HIP) && defined(__HIP_DEVICE_COMPILE__)) || \
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@ -603,15 +565,14 @@ static constexpr bool kokkos_omp_on_host() { return false; }
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#define KOKKOS_ENABLE_TASKDAG
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#endif
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#if defined(KOKKOS_ENABLE_CUDA) && defined(KOKKOS_ENABLE_DEPRECATED_CODE_4)
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#define KOKKOS_ENABLE_CUDA_LDG_INTRINSIC
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#endif
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#define KOKKOS_INVALID_INDEX (~std::size_t(0))
|
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#define KOKKOS_IMPL_CTOR_DEFAULT_ARG KOKKOS_INVALID_INDEX
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||||
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#ifdef KOKKOS_ENABLE_DEPRECATED_CODE_3
|
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#define KOKKOS_CONSTEXPR_14 constexpr
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#define KOKKOS_DEPRECATED_TRAILING_ATTRIBUTE
|
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#endif
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||||
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// Guard intel compiler version 19 and older
|
||||
// intel error #2651: attribute does not apply to any entity
|
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// using <deprecated_type> KOKKOS_DEPRECATED = ...
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@ -637,25 +598,16 @@ static constexpr bool kokkos_omp_on_host() { return false; }
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#define KOKKOS_IMPL_WARNING(desc) KOKKOS_IMPL_DO_PRAGMA(message(#desc))
|
||||
#endif
|
||||
|
||||
// DJS 05/28/2019: Bugfix: Issue 2155
|
||||
// Use KOKKOS_ENABLE_CUDA_LDG_INTRINSIC to avoid memory leak in RandomAccess
|
||||
// View
|
||||
#if defined(KOKKOS_ENABLE_CUDA) && !defined(KOKKOS_ENABLE_CUDA_LDG_INTRINSIC)
|
||||
#define KOKKOS_ENABLE_CUDA_LDG_INTRINSIC
|
||||
#endif
|
||||
|
||||
#if defined(KOKKOS_ENABLE_CXX17) || defined(KOKKOS_ENABLE_CXX20)
|
||||
#define KOKKOS_ATTRIBUTE_NODISCARD [[nodiscard]]
|
||||
#else
|
||||
#define KOKKOS_ATTRIBUTE_NODISCARD
|
||||
#endif
|
||||
|
||||
#if (defined(KOKKOS_COMPILER_GNU) || defined(KOKKOS_COMPILER_CLANG) || \
|
||||
defined(KOKKOS_COMPILER_INTEL) || defined(KOKKOS_COMPILER_PGI)) && \
|
||||
!defined(_WIN32)
|
||||
!defined(_WIN32) && !defined(__ANDROID__)
|
||||
#if __has_include(<execinfo.h>)
|
||||
#if (!defined(__linux__) || defined(__GLIBC_MINOR__))
|
||||
#define KOKKOS_IMPL_ENABLE_STACKTRACE
|
||||
#endif
|
||||
#endif
|
||||
#define KOKKOS_IMPL_ENABLE_CXXABI
|
||||
#endif
|
||||
|
||||
@ -666,11 +618,6 @@ static constexpr bool kokkos_omp_on_host() { return false; }
|
||||
#undef __CUDA_ARCH__
|
||||
#endif
|
||||
|
||||
#ifdef KOKKOS_ENABLE_DEPRECATED_CODE_3
|
||||
#define KOKKOS_THREAD_LOCAL \
|
||||
KOKKOS_DEPRECATED_WITH_COMMENT("Use thread_local instead!") thread_local
|
||||
#endif
|
||||
|
||||
#if (defined(KOKKOS_IMPL_WINDOWS_CUDA) || defined(KOKKOS_COMPILER_MSVC)) && \
|
||||
!defined(KOKKOS_COMPILER_CLANG)
|
||||
// MSVC (as of 16.5.5 at least) does not do empty base class optimization by
|
||||
|
||||
Reference in New Issue
Block a user