| # | Line 24 | Line 24 | class Thermo{ | |
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| 24 | ||
| 25 | double getPressure(); // gives the instant pressure in atm; | |
| 26 | ||
| 27 | < | void getPressureTensor(Mat3x3d pressureTessor); // gives the pressure tensor in amu*fs^-2*Ang^-1 |
| 27 | > | Mat3x3d getPressureTensor(); // gives the pressure tensor in amu*fs^-2*Ang^-1 |
| 28 | double getVolume(); // gives the volume in Ang^3 | |
| 29 | ||
| 30 | void saveStat(); | |
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