MD-Bench/src/includes/parameter.h

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/*
* =======================================================================================
*
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* Author: Jan Eitzinger (je), jan.eitzinger@fau.de
* Copyright (c) 2020 RRZE, University Erlangen-Nuremberg
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*
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* This file is part of MD-Bench.
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*
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* MD-Bench is free software: you can redistribute it and/or modify it
* under the terms of the GNU Lesser General Public License as published
* by the Free Software Foundation, either version 3 of the License, or
* (at your option) any later version.
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*
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* MD-Bench is distributed in the hope that it will be useful, but WITHOUT ANY
* WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS FOR A
* PARTICULAR PURPOSE. See the GNU Lesser General Public License for more
* details.
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*
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* You should have received a copy of the GNU Lesser General Public License along
* with MD-Bench. If not, see <https://www.gnu.org/licenses/>.
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* =======================================================================================
*/
#ifndef __PARAMETER_H_
#define __PARAMETER_H_
typedef struct {
double epsilon;
double sigma6;
double temp;
double rho;
double mass;
int ntimes;
int nstat;
int every;
double dt;
double dtforce;
double cutforce;
double cutneigh;
int nx, ny, nz;
double xprd, yprd, zprd;
} Parameter;
#endif