properly initialize result storage for per-chunk arrays
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@ -323,7 +323,7 @@ void ComputeReduceChunk::compute_one(int m, double *vchunk, int nstride)
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{
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{
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// initialize per-chunk values in accumulation vector
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// initialize per-chunk values in accumulation vector
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for (int i = 0; i < nchunk; i += nstride) vchunk[i] = initvalue;
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for (int i = 0; i < nvalues*nchunk; i += nstride) vchunk[i] = initvalue;
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// loop over my atoms
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// loop over my atoms
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// use peratom input and chunk ID of each atom to update vector
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// use peratom input and chunk ID of each atom to update vector
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