LAMMPS » History » Version 1

Gabriel Winckler, 09 Feb 2012 16:28

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h1. LAMMPS
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Exemplo:
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<pre>
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APP=lammps
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CASE="lammps-parallel"
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INPUT="in.reaxc.rdx data.rdx ffield.reax"
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ARGS="-in in.reaxc.rdx -log ${CASE}.log"
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OUTPUT="${CASE}.log"
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HOSTS=4
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QUEUE=short
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</pre>
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Defaults do template:
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* ARGS=-in $INPUT
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* PROGRESS=(stdout)
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Parâmetros:
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* CASE - Nome do caso. Define o nome de arquivos de entrada, log e saida. *Padrão:* (nome do arquivo de parâmetros, sem a extensão)
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* HOSTS - Número de hosts (processos) para a execução. *Padrão:* 1 (modo serial)
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