PyPI - ncrystal-python - Versions diffs - 3.9.87__tar.gz → 3.9.88__tar.gz - Mend

ncrystal-python 3.9.87tar.gz → 3.9.88tar.gz

This diff represents the content of publicly available package versions that have been released to one of the supported registries. The information contained in this diff is provided for informational purposes only and reflects changes between package versions as they appear in their respective public registries.

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{ncrystal_python-3.9.87/ncrystal_python.egg-info → ncrystal_python-3.9.88}/PKG-INFO RENAMED Viewed

@@ -1,6 +1,6 @@
 Metadata-Version: 2.2
 Name: ncrystal-python
-Version: 3.9.87
+Version: 3.9.88
 Summary: Library for thermal neutron transport in crystals and other materials.
 Author: NCrystal developers (Thomas Kittelmann, Xiao Xiao Cai)
 License: The Apache 2.0 license is reproduced in the following. See the NOTICE file for
@@ -236,8 +236,8 @@ facilitate integration into existing simulation frameworks such as OpenMC
 code or via command-line tools. While the C++ library is designed with a high
 degree of flexibility in mind for developers, typical end-user configuration is
 deliberately kept simple and uniform across various applications and APIs - this
-for instance allows tuning and validation of a particular crystal setup to be
-performed in one tool before it is then deployed in another.
+for instance allows tuning and validation of a particular material configuration
+to be performed in one tool before it is then deployed in another.
 In addition to code and tools, the NCrystal distribution also includes a set of
 validated data files, covering many crystals important at neutron scattering
@@ -309,16 +309,17 @@ $> nctool 'Al_sg225.ncmat;temp=10C'
-Using the NCrystal installation from C++ (including Geant4), C or Python code
+Using the NCrystal installation from C++, C or Python code
 -----------------------------------------------------------------------------
-If you wish to use NCrystal from Python code, there is no special setup
-needed. If you on the other hand wish to use NCrystal from your compiled C++ or
-C code, you must put appropriate build flags. The recommended way is using CMake
-to do this (see next section), but otherwise you must ensure that the NCrystal
-header files are in your compiler's include path, and that the NCrystal library
-is linked correctly. Here are some examples of how this could for instance be
-done, with a C and a C++ app respectively:
+If you wish to use NCrystal from Python code, there is no special setup needed,
+assuming NCrystal was installed correctly (cf. INSTALL.md). If you on the other
+hand wish to use NCrystal from your compiled C++ or C code, you must put
+appropriate build flags. The recommended way is using CMake to do this (see next
+section), but otherwise you must ensure that the NCrystal header files are in
+your compiler's include path, and that the NCrystal library is linked
+correctly. Here are some examples of how this could for instance be done, with a
+C and a C++ app respectively:
    export LDFLAGS="${LDFLAGS:-} -Wl,-rpath,$(ncrystal-config --show libdir) $(ncrystal-config --show libpath)"
    export CFLAGS="${CFLAGS:-} -I$(ncrystal-config --show includedir)"
@@ -326,22 +327,17 @@ done, with a C and a C++ app respectively:
    cc -std=c11 ${LDFLAGS} ${CFLAGS} my_c_code.c -o my_c_app
    c++ -std=c++17 ${LDFLAGS} ${CXXFLAGS} my_cpp_code.cpp -o my_cpp_app
-If using the NCrystal-Geant4 interfaces, you should also add "-lG4NCrystal" to
-the link flags.
 Then, in your code you can access the relevant APIs with with statements like:
   #include "NCrystal/NCrystal.hh"     // C++ code, core NCrystal
-  #include "G4NCrystal/G4NCrystal.hh" // C++ code, for Geant4 users
   #include "NCrystal/ncrystal.h"      // C code
   import NCrystal                     ## Python code
 In the ./examples/ directory of your NCrystal distribution that you got after
 downloading and unpacking the NCrystal source tar-ball, you will find small
-examples of code using NCrystal. For C++/C and Geant4, there is currently no
-documentation beyond the header files and examples. In the case of Python, there
-is integrated documentation available via the usual "help" function, accessed
-with:
+examples of code using NCrystal. For C++/C, there is currently no documentation
+beyond the header files and examples. In the case of Python, there is integrated
+documentation available via the usual "help" function, accessed with:
   import NCrystal
   help(NCrystal)
@@ -369,10 +365,10 @@ CMake code for a small project using NCrystal might look like the following
   cmake_minimum_required(VERSION 3.10...3.26)
   project(MyExampleProject LANGUAGES CXX)
-  execute_process( COMMAND ncrystal-config --show cmakedir
+  execute_process( COMMAND "ncrystal-config" "--show" "cmakedir"
                    OUTPUT_VARIABLE NCrystal_DIR
                    OUTPUT_STRIP_TRAILING_WHITESPACE )
-  find_package(NCrystal REQUIRED)
+  find_package(NCrystal 4.0.0 REQUIRED)
   add_executable(exampleapp "${PROJECT_SOURCE_DIR}/exampleapp.cc")
   target_link_libraries( exampleapp NCrystal::NCrystal )
   install( TARGETS exampleapp DESTINATION bin )
@@ -382,22 +378,21 @@ required before the code can work in an environment where the NCrystal CMake
 modules are not automatically injected into the CMake package search path (this
 notably includes NCrystal installed via "pip install ncrystal").
-If the NCrystal-Geant4 bindings are needed, they must be explicitly requested,
-and the NCrystal::G4NCrystal target added as a dependency for downstream code:
-  find_package(NCrystal REQUIRED COMPONENTS GEANT4BINDINGS )
-  target_link_libraries( exampleapp NCrystal::G4NCrystal )
-This will of course fail if NCrystal was not build with Geant4 support
-(i.e. configured with -DNCRYSTAL_ENABLE_GEANT4=ON). Note: currently (August
-2024), NCrystal conda and pip packages are built *without* Geant4 support.
+Using the NCrystal with Geant4
+------------------------------
+The instructions for the NCrystal-Geant4 bindings are currently being
+updated. Once complete, they will appear on
+https://github.com/mctools/ncrystal-geant4
-Using the NCrystal installation from OpenMC
------------------------------------------------------------------------------
-Using NCrystal materials in openmc is supported since OpenMC release 13.3, and
+Using NCrystal with OpenMC
+--------------------------
+Using NCrystal materials in OpenMc is supported since OpenMC release 13.3, and
 uses a nice simple syntax in the Python API:
 ```
@@ -454,8 +449,8 @@ the sections:
-Using the NCrystal installation from McStas
------------------------------------------------------------------------------
+Using NCrystal with McStas
+--------------------------
 NOTE: The following discussion concerns the modern McStas 3 branch, and might in
 particular not be 100% accurate for releases earlier than McStas 3.3 (probably
@@ -471,9 +466,8 @@ the correct settings for doing so. Thus, you can always invoke "ncrystal-config
 active. Depending on how you installed McStas, NCrystal is most likely already
 available. If not, you can try one of the following ways of enabling it:
-   $> conda install -c conda-forge ncrystal [if you are in a conda-forge env]
+   $> conda install conda-forge::ncrystal [if you are in a conda-forge env]
    $> python3 -mpip install ncrystal [for non-conda users]
-   $> . $MCSTAS/setup.sh [obsolete way]
 It is beyond the scope for this README to provide a full documentation of
 McStas, or the Union sub-system, but if you are using McStasScript to compose
@@ -511,4 +505,5 @@ For more documentation about the NCrystal_sample component, run:
 $> mcdoc NCrystal_sample
-Or consult the documentation online at https://www.mcstas.org/download/components/
+Or consult the documentation online at
+https://www.mcstas.org/download/components/

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88}/README.md RENAMED Viewed

@@ -15,8 +15,8 @@ facilitate integration into existing simulation frameworks such as OpenMC
 code or via command-line tools. While the C++ library is designed with a high
 degree of flexibility in mind for developers, typical end-user configuration is
 deliberately kept simple and uniform across various applications and APIs - this
-for instance allows tuning and validation of a particular crystal setup to be
-performed in one tool before it is then deployed in another.
+for instance allows tuning and validation of a particular material configuration
+to be performed in one tool before it is then deployed in another.
 In addition to code and tools, the NCrystal distribution also includes a set of
 validated data files, covering many crystals important at neutron scattering
@@ -88,16 +88,17 @@ $> nctool 'Al_sg225.ncmat;temp=10C'
-Using the NCrystal installation from C++ (including Geant4), C or Python code
+Using the NCrystal installation from C++, C or Python code
 -----------------------------------------------------------------------------
-If you wish to use NCrystal from Python code, there is no special setup
-needed. If you on the other hand wish to use NCrystal from your compiled C++ or
-C code, you must put appropriate build flags. The recommended way is using CMake
-to do this (see next section), but otherwise you must ensure that the NCrystal
-header files are in your compiler's include path, and that the NCrystal library
-is linked correctly. Here are some examples of how this could for instance be
-done, with a C and a C++ app respectively:
+If you wish to use NCrystal from Python code, there is no special setup needed,
+assuming NCrystal was installed correctly (cf. INSTALL.md). If you on the other
+hand wish to use NCrystal from your compiled C++ or C code, you must put
+appropriate build flags. The recommended way is using CMake to do this (see next
+section), but otherwise you must ensure that the NCrystal header files are in
+your compiler's include path, and that the NCrystal library is linked
+correctly. Here are some examples of how this could for instance be done, with a
+C and a C++ app respectively:
    export LDFLAGS="${LDFLAGS:-} -Wl,-rpath,$(ncrystal-config --show libdir) $(ncrystal-config --show libpath)"
    export CFLAGS="${CFLAGS:-} -I$(ncrystal-config --show includedir)"
@@ -105,22 +106,17 @@ done, with a C and a C++ app respectively:
    cc -std=c11 ${LDFLAGS} ${CFLAGS} my_c_code.c -o my_c_app
    c++ -std=c++17 ${LDFLAGS} ${CXXFLAGS} my_cpp_code.cpp -o my_cpp_app
-If using the NCrystal-Geant4 interfaces, you should also add "-lG4NCrystal" to
-the link flags.
 Then, in your code you can access the relevant APIs with with statements like:
   #include "NCrystal/NCrystal.hh"     // C++ code, core NCrystal
-  #include "G4NCrystal/G4NCrystal.hh" // C++ code, for Geant4 users
   #include "NCrystal/ncrystal.h"      // C code
   import NCrystal                     ## Python code
 In the ./examples/ directory of your NCrystal distribution that you got after
 downloading and unpacking the NCrystal source tar-ball, you will find small
-examples of code using NCrystal. For C++/C and Geant4, there is currently no
-documentation beyond the header files and examples. In the case of Python, there
-is integrated documentation available via the usual "help" function, accessed
-with:
+examples of code using NCrystal. For C++/C, there is currently no documentation
+beyond the header files and examples. In the case of Python, there is integrated
+documentation available via the usual "help" function, accessed with:
   import NCrystal
   help(NCrystal)
@@ -148,10 +144,10 @@ CMake code for a small project using NCrystal might look like the following
   cmake_minimum_required(VERSION 3.10...3.26)
   project(MyExampleProject LANGUAGES CXX)
-  execute_process( COMMAND ncrystal-config --show cmakedir
+  execute_process( COMMAND "ncrystal-config" "--show" "cmakedir"
                    OUTPUT_VARIABLE NCrystal_DIR
                    OUTPUT_STRIP_TRAILING_WHITESPACE )
-  find_package(NCrystal REQUIRED)
+  find_package(NCrystal 4.0.0 REQUIRED)
   add_executable(exampleapp "${PROJECT_SOURCE_DIR}/exampleapp.cc")
   target_link_libraries( exampleapp NCrystal::NCrystal )
   install( TARGETS exampleapp DESTINATION bin )
@@ -161,22 +157,21 @@ required before the code can work in an environment where the NCrystal CMake
 modules are not automatically injected into the CMake package search path (this
 notably includes NCrystal installed via "pip install ncrystal").
-If the NCrystal-Geant4 bindings are needed, they must be explicitly requested,
-and the NCrystal::G4NCrystal target added as a dependency for downstream code:
-  find_package(NCrystal REQUIRED COMPONENTS GEANT4BINDINGS )
-  target_link_libraries( exampleapp NCrystal::G4NCrystal )
-This will of course fail if NCrystal was not build with Geant4 support
-(i.e. configured with -DNCRYSTAL_ENABLE_GEANT4=ON). Note: currently (August
-2024), NCrystal conda and pip packages are built *without* Geant4 support.
+Using the NCrystal with Geant4
+------------------------------
+The instructions for the NCrystal-Geant4 bindings are currently being
+updated. Once complete, they will appear on
+https://github.com/mctools/ncrystal-geant4
-Using the NCrystal installation from OpenMC
------------------------------------------------------------------------------
-Using NCrystal materials in openmc is supported since OpenMC release 13.3, and
+Using NCrystal with OpenMC
+--------------------------
+Using NCrystal materials in OpenMc is supported since OpenMC release 13.3, and
 uses a nice simple syntax in the Python API:
 ```
@@ -233,8 +228,8 @@ the sections:
-Using the NCrystal installation from McStas
------------------------------------------------------------------------------
+Using NCrystal with McStas
+--------------------------
 NOTE: The following discussion concerns the modern McStas 3 branch, and might in
 particular not be 100% accurate for releases earlier than McStas 3.3 (probably
@@ -250,9 +245,8 @@ the correct settings for doing so. Thus, you can always invoke "ncrystal-config
 active. Depending on how you installed McStas, NCrystal is most likely already
 available. If not, you can try one of the following ways of enabling it:
-   $> conda install -c conda-forge ncrystal [if you are in a conda-forge env]
+   $> conda install conda-forge::ncrystal [if you are in a conda-forge env]
    $> python3 -mpip install ncrystal [for non-conda users]
-   $> . $MCSTAS/setup.sh [obsolete way]
 It is beyond the scope for this README to provide a full documentation of
 McStas, or the Union sub-system, but if you are using McStasScript to compose
@@ -290,4 +284,5 @@ For more documentation about the NCrystal_sample component, run:
 $> mcdoc NCrystal_sample
-Or consult the documentation online at https://www.mcstas.org/download/components/
+Or consult the documentation online at
+https://www.mcstas.org/download/components/

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/__init__.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##
@@ -30,7 +30,7 @@ Please find more information about NCrystal at the website:
 In particular, a small example using the NCrystal python module can be found at:
-   https://github.com/mctools/ncrystal/blob/master/examples/ncrystal_example_py
+   https://github.com/mctools/ncrystal/blob/HEAD/examples/ncrystal_example_py
 A substantial effort went into developing NCrystal. If you use it for your work,
 we would appreciate it if you would use the following reference in your work:
@@ -55,7 +55,7 @@ For detailed usage conditions and licensing of this open source project, see:
 #NB: Synchronize meta-data below with fields in setup.py+template_setup.py.in meta data:
 __license__ = "Apache 2.0, http://www.apache.org/licenses/LICENSE-2.0"
-__version__ = '3.9.87'
+__version__ = '3.9.88'
 __status__ = "Production"
 __author__ = "NCrystal developers (Thomas Kittelmann, Xiao Xiao Cai)"
 __copyright__ = "Copyright 2015-2024 %s"%__author__

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/__main__.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_chooks.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_cli_cif2ncmat.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_cli_endf2ncmat.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##
@@ -305,7 +305,7 @@ Note that this script exists for the benefit of experts only. Most users are
 recommended to simply download and use one of the pre-converted files shipped
 with NCrystal or found at:
-    https://github.com/mctools/ncrystal-extra/tree/master/data
+    https://github.com/mctools/ncrystal-extra/tree/HEAD/data
 Only information for NCMAT @DYNINFO sections are extracted from ENDF files, so
 it is recommended to provide the initial parts of the target NCMAT file in a

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_cli_hfg2ncmat.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_cli_mcstasunion.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_cli_ncmat2cpp.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_cli_ncmat2hkl.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_cli_nctool.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_cli_vdos2ncmat.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_cli_verifyatompos.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_cliimpl.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_cliwrap_config.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_common.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_coreimpl.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_hfgdata.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_hklobjects.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_locatelib.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_miscimpl.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_mmc.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_msg.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_ncmat2cpp_impl.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_ncmatimpl.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_numpy.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/_testimpl.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##
@@ -138,7 +138,7 @@ def _actualtest( verbose ):
     #and to avoid consuming random numbers from other streams.
     alpc = NC.createScatterIndependentRNG(_cfgstr2)
     prfct('Verifying loaded Scatter object')
-    require( alpc.name == 'PCBragg' )
+    require( alpc.name == 'PowderBragg' )
     require( isinstance(alpc.name,str) )
     require( alpc.refCount() in (1,2) )
     require( type(alpc.refCount()) == int ) # noqa E721

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/api.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/atomdata.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/cfgstr.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/cifutils.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/cli.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/constants.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/core.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/datasrc.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/exceptions.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/hfg2ncmat.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/mcstasutils.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/misc.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/mmc.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/ncmat.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/ncmat2cpp.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/obsolete.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/plot.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/plugins.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/test.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src}/NCrystal/vdos.py RENAMED Viewed

@@ -3,7 +3,7 @@
 ##                                                                            ##
 ##  This file is part of NCrystal (see https://mctools.github.io/ncrystal/)   ##
 ##                                                                            ##
-##  Copyright 2015-2024 NCrystal developers                                   ##
+##  Copyright 2015-2025 NCrystal developers                                   ##
 ##                                                                            ##
 ##  Licensed under the Apache License, Version 2.0 (the "License");           ##
 ##  you may not use this file except in compliance with the License.          ##

{ncrystal_python-3.9.87 → ncrystal_python-3.9.88/src/ncrystal_python.egg-info}/PKG-INFO RENAMED Viewed

@@ -1,6 +1,6 @@
 Metadata-Version: 2.2
 Name: ncrystal-python
-Version: 3.9.87
+Version: 3.9.88
 Summary: Library for thermal neutron transport in crystals and other materials.
 Author: NCrystal developers (Thomas Kittelmann, Xiao Xiao Cai)
 License: The Apache 2.0 license is reproduced in the following. See the NOTICE file for
@@ -236,8 +236,8 @@ facilitate integration into existing simulation frameworks such as OpenMC
 code or via command-line tools. While the C++ library is designed with a high
 degree of flexibility in mind for developers, typical end-user configuration is
 deliberately kept simple and uniform across various applications and APIs - this
-for instance allows tuning and validation of a particular crystal setup to be
-performed in one tool before it is then deployed in another.
+for instance allows tuning and validation of a particular material configuration
+to be performed in one tool before it is then deployed in another.
 In addition to code and tools, the NCrystal distribution also includes a set of
 validated data files, covering many crystals important at neutron scattering
@@ -309,16 +309,17 @@ $> nctool 'Al_sg225.ncmat;temp=10C'
-Using the NCrystal installation from C++ (including Geant4), C or Python code
+Using the NCrystal installation from C++, C or Python code
 -----------------------------------------------------------------------------
-If you wish to use NCrystal from Python code, there is no special setup
-needed. If you on the other hand wish to use NCrystal from your compiled C++ or
-C code, you must put appropriate build flags. The recommended way is using CMake
-to do this (see next section), but otherwise you must ensure that the NCrystal
-header files are in your compiler's include path, and that the NCrystal library
-is linked correctly. Here are some examples of how this could for instance be
-done, with a C and a C++ app respectively:
+If you wish to use NCrystal from Python code, there is no special setup needed,
+assuming NCrystal was installed correctly (cf. INSTALL.md). If you on the other
+hand wish to use NCrystal from your compiled C++ or C code, you must put
+appropriate build flags. The recommended way is using CMake to do this (see next
+section), but otherwise you must ensure that the NCrystal header files are in
+your compiler's include path, and that the NCrystal library is linked
+correctly. Here are some examples of how this could for instance be done, with a
+C and a C++ app respectively:
    export LDFLAGS="${LDFLAGS:-} -Wl,-rpath,$(ncrystal-config --show libdir) $(ncrystal-config --show libpath)"
    export CFLAGS="${CFLAGS:-} -I$(ncrystal-config --show includedir)"
@@ -326,22 +327,17 @@ done, with a C and a C++ app respectively:
    cc -std=c11 ${LDFLAGS} ${CFLAGS} my_c_code.c -o my_c_app
    c++ -std=c++17 ${LDFLAGS} ${CXXFLAGS} my_cpp_code.cpp -o my_cpp_app
-If using the NCrystal-Geant4 interfaces, you should also add "-lG4NCrystal" to
-the link flags.
 Then, in your code you can access the relevant APIs with with statements like:
   #include "NCrystal/NCrystal.hh"     // C++ code, core NCrystal
-  #include "G4NCrystal/G4NCrystal.hh" // C++ code, for Geant4 users
   #include "NCrystal/ncrystal.h"      // C code
   import NCrystal                     ## Python code
 In the ./examples/ directory of your NCrystal distribution that you got after
 downloading and unpacking the NCrystal source tar-ball, you will find small
-examples of code using NCrystal. For C++/C and Geant4, there is currently no
-documentation beyond the header files and examples. In the case of Python, there
-is integrated documentation available via the usual "help" function, accessed
-with:
+examples of code using NCrystal. For C++/C, there is currently no documentation
+beyond the header files and examples. In the case of Python, there is integrated
+documentation available via the usual "help" function, accessed with:
   import NCrystal
   help(NCrystal)
@@ -369,10 +365,10 @@ CMake code for a small project using NCrystal might look like the following
   cmake_minimum_required(VERSION 3.10...3.26)
   project(MyExampleProject LANGUAGES CXX)
-  execute_process( COMMAND ncrystal-config --show cmakedir
+  execute_process( COMMAND "ncrystal-config" "--show" "cmakedir"
                    OUTPUT_VARIABLE NCrystal_DIR
                    OUTPUT_STRIP_TRAILING_WHITESPACE )
-  find_package(NCrystal REQUIRED)
+  find_package(NCrystal 4.0.0 REQUIRED)
   add_executable(exampleapp "${PROJECT_SOURCE_DIR}/exampleapp.cc")
   target_link_libraries( exampleapp NCrystal::NCrystal )
   install( TARGETS exampleapp DESTINATION bin )
@@ -382,22 +378,21 @@ required before the code can work in an environment where the NCrystal CMake
 modules are not automatically injected into the CMake package search path (this
 notably includes NCrystal installed via "pip install ncrystal").
-If the NCrystal-Geant4 bindings are needed, they must be explicitly requested,
-and the NCrystal::G4NCrystal target added as a dependency for downstream code:
-  find_package(NCrystal REQUIRED COMPONENTS GEANT4BINDINGS )
-  target_link_libraries( exampleapp NCrystal::G4NCrystal )
-This will of course fail if NCrystal was not build with Geant4 support
-(i.e. configured with -DNCRYSTAL_ENABLE_GEANT4=ON). Note: currently (August
-2024), NCrystal conda and pip packages are built *without* Geant4 support.
+Using the NCrystal with Geant4
+------------------------------
+The instructions for the NCrystal-Geant4 bindings are currently being
+updated. Once complete, they will appear on
+https://github.com/mctools/ncrystal-geant4
-Using the NCrystal installation from OpenMC
------------------------------------------------------------------------------
-Using NCrystal materials in openmc is supported since OpenMC release 13.3, and
+Using NCrystal with OpenMC
+--------------------------
+Using NCrystal materials in OpenMc is supported since OpenMC release 13.3, and
 uses a nice simple syntax in the Python API:
 ```
@@ -454,8 +449,8 @@ the sections:
-Using the NCrystal installation from McStas
------------------------------------------------------------------------------
+Using NCrystal with McStas
+--------------------------
 NOTE: The following discussion concerns the modern McStas 3 branch, and might in
 particular not be 100% accurate for releases earlier than McStas 3.3 (probably
@@ -471,9 +466,8 @@ the correct settings for doing so. Thus, you can always invoke "ncrystal-config
 active. Depending on how you installed McStas, NCrystal is most likely already
 available. If not, you can try one of the following ways of enabling it:
-   $> conda install -c conda-forge ncrystal [if you are in a conda-forge env]
+   $> conda install conda-forge::ncrystal [if you are in a conda-forge env]
    $> python3 -mpip install ncrystal [for non-conda users]
-   $> . $MCSTAS/setup.sh [obsolete way]
 It is beyond the scope for this README to provide a full documentation of
 McStas, or the Union sub-system, but if you are using McStasScript to compose
@@ -511,4 +505,5 @@ For more documentation about the NCrystal_sample component, run:
 $> mcdoc NCrystal_sample
-Or consult the documentation online at https://www.mcstas.org/download/components/
+Or consult the documentation online at
+https://www.mcstas.org/download/components/

ncrystal_python-3.9.88/src/ncrystal_python.egg-info/SOURCES.txt ADDED Viewed

@@ -0,0 +1,56 @@
+LICENSE
+README.md
+pyproject.toml
+src/NCrystal/__init__.py
+src/NCrystal/__main__.py
+src/NCrystal/_chooks.py
+src/NCrystal/_cli_cif2ncmat.py
+src/NCrystal/_cli_endf2ncmat.py
+src/NCrystal/_cli_hfg2ncmat.py
+src/NCrystal/_cli_mcstasunion.py
+src/NCrystal/_cli_ncmat2cpp.py
+src/NCrystal/_cli_ncmat2hkl.py
+src/NCrystal/_cli_nctool.py
+src/NCrystal/_cli_vdos2ncmat.py
+src/NCrystal/_cli_verifyatompos.py
+src/NCrystal/_cliimpl.py
+src/NCrystal/_cliwrap_config.py
+src/NCrystal/_common.py
+src/NCrystal/_coreimpl.py
+src/NCrystal/_hfgdata.py
+src/NCrystal/_hklobjects.py
+src/NCrystal/_is_std.py
+src/NCrystal/_locatelib.py
+src/NCrystal/_miscimpl.py
+src/NCrystal/_mmc.py
+src/NCrystal/_msg.py
+src/NCrystal/_ncmat2cpp_impl.py
+src/NCrystal/_ncmatimpl.py
+src/NCrystal/_numpy.py
+src/NCrystal/_testimpl.py
+src/NCrystal/api.py
+src/NCrystal/atomdata.py
+src/NCrystal/cfgstr.py
+src/NCrystal/cifutils.py
+src/NCrystal/cli.py
+src/NCrystal/constants.py
+src/NCrystal/core.py
+src/NCrystal/datasrc.py
+src/NCrystal/exceptions.py
+src/NCrystal/hfg2ncmat.py
+src/NCrystal/mcstasutils.py
+src/NCrystal/misc.py
+src/NCrystal/mmc.py
+src/NCrystal/ncmat.py
+src/NCrystal/ncmat2cpp.py
+src/NCrystal/obsolete.py
+src/NCrystal/plot.py
+src/NCrystal/plugins.py
+src/NCrystal/test.py
+src/NCrystal/vdos.py
+src/ncrystal_python.egg-info/PKG-INFO
+src/ncrystal_python.egg-info/SOURCES.txt
+src/ncrystal_python.egg-info/dependency_links.txt
+src/ncrystal_python.egg-info/entry_points.txt
+src/ncrystal_python.egg-info/requires.txt
+src/ncrystal_python.egg-info/top_level.txt

ncrystal_python-3.9.87/ncrystal_python.egg-info/SOURCES.txt DELETED Viewed

@@ -1,56 +0,0 @@
-LICENSE
-README.md
-pyproject.toml
-NCrystal/__init__.py
-NCrystal/__main__.py
-NCrystal/_chooks.py
-NCrystal/_cli_cif2ncmat.py
-NCrystal/_cli_endf2ncmat.py
-NCrystal/_cli_hfg2ncmat.py
-NCrystal/_cli_mcstasunion.py
-NCrystal/_cli_ncmat2cpp.py
-NCrystal/_cli_ncmat2hkl.py
-NCrystal/_cli_nctool.py
-NCrystal/_cli_vdos2ncmat.py
-NCrystal/_cli_verifyatompos.py
-NCrystal/_cliimpl.py
-NCrystal/_cliwrap_config.py
-NCrystal/_common.py
-NCrystal/_coreimpl.py
-NCrystal/_hfgdata.py
-NCrystal/_hklobjects.py
-NCrystal/_is_std.py
-NCrystal/_locatelib.py
-NCrystal/_miscimpl.py
-NCrystal/_mmc.py
-NCrystal/_msg.py
-NCrystal/_ncmat2cpp_impl.py
-NCrystal/_ncmatimpl.py
-NCrystal/_numpy.py
-NCrystal/_testimpl.py
-NCrystal/api.py
-NCrystal/atomdata.py
-NCrystal/cfgstr.py
-NCrystal/cifutils.py
-NCrystal/cli.py
-NCrystal/constants.py
-NCrystal/core.py
-NCrystal/datasrc.py
-NCrystal/exceptions.py
-NCrystal/hfg2ncmat.py
-NCrystal/mcstasutils.py
-NCrystal/misc.py
-NCrystal/mmc.py
-NCrystal/ncmat.py
-NCrystal/ncmat2cpp.py
-NCrystal/obsolete.py
-NCrystal/plot.py
-NCrystal/plugins.py
-NCrystal/test.py
-NCrystal/vdos.py
-ncrystal_python.egg-info/PKG-INFO
-ncrystal_python.egg-info/SOURCES.txt
-ncrystal_python.egg-info/dependency_links.txt
-ncrystal_python.egg-info/entry_points.txt
-ncrystal_python.egg-info/requires.txt
-ncrystal_python.egg-info/top_level.txt