From: Philipp Schön (phschoen_at_web.de)
Date: Mon Aug 13 2007 - 07:28:39 CDT
dear users
does anyone know what this error message is exactly referring to?
I use a berendsen pressure bath having the following parameter set:
if {1} {
BerendsenPressure on
BerendsenPressureTarget 1.01325
BerendsenPressureCompressibility 0.0000457
BerendsenPressureRelaxationTime 200
BerendsenPressureFreq 20
}
Any clue?
Cheers
Philipp
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