50 |
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51 |
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namespace OpenMD { |
52 |
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|
53 |
< |
UniformGradient::UniformGradient(SimInfo* info) : info_(info), |
54 |
< |
doUniformGradient(false), |
55 |
< |
doParticlePot(false), |
56 |
< |
initialized(false) { |
53 |
> |
UniformGradient::UniformGradient(SimInfo* info) : initialized(false), |
54 |
> |
doUniformGradient(false), |
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> |
doParticlePot(false), |
56 |
> |
info_(info) { |
57 |
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simParams = info_->getSimParams(); |
58 |
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} |
59 |
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119 |
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Grad_(2,2) = 2.0 * (a_.z()*b_.z() - cpsi_ / 3.0); |
120 |
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121 |
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Grad_ *= g_ / 2.0; |
122 |
+ |
|
123 |
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} else { |
124 |
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if (!haveA) { |
125 |
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sprintf(painCave.errMsg, |