technical:recipes:quantum-espresso

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technical:recipes:quantum-espresso [2024-05-12 11:03] – [Versions] bkangtechnical:recipes:quantum-espresso [2024-05-12 11:05] (current) – [Runtime environment] bkang
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       contexts: all       contexts: all
       dependencies: {       dependencies: {
-        openmpi/4.1.5:intel-2023+        openmpi/4.1.5:intel-oneapi-2023
       }       }
       compiled with Open MPI, Intel compilers, MKL, ScaLAPACK       compiled with Open MPI, Intel compilers, MKL, ScaLAPACK
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 <code bash> <code bash>
 [user@login00.darwin ~]$ vpkg_require quantum-espresso/v7.3 [user@login00.darwin ~]$ vpkg_require quantum-espresso/v7.3
-Adding dependency `libfabric/1.13.2` to your environment +Adding dependency `binutils/2.35.1` to your environment 
-Adding dependency `binutils/2.35` to your environment +Adding dependency `gcc/12.2.0` to your environment
-Adding dependency `gcc/12.1.0` to your environment+
 Adding dependency `intel-oneapi/2023.0.0.25537` to your environment Adding dependency `intel-oneapi/2023.0.0.25537` to your environment
-Adding dependency `openmpi/4.1.4:intel-oneapi-2023` to your environment+Adding dependency `ucx/1.13.1` to your environment 
 +Adding dependency `openmpi/4.1.5:intel-oneapi-2023` to your environment
 Adding package `quantum-espresso/v7.3` to your environment Adding package `quantum-espresso/v7.3` to your environment
 [user@login00.darwin ~]$ which pw.x [user@login00.darwin ~]$ which pw.x
  • technical/recipes/quantum-espresso.1715526207.txt.gz
  • Last modified: 2024-05-12 11:03
  • by bkang