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Merge pull request #3330 from lammps/extract-atom-sp

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Add per-atom sp array to extract()
This commit is contained in:
Axel Kohlmeyer
2022-07-02 12:04:50 -04:00
committed by GitHub
parent 8e4b3fd41b 2d366ce220
commit d7919f3a4e
1 changed files with 9 additions and 0 deletions
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9
src/atom.cpp
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@ -2659,10 +2659,18 @@ void *Atom::extract(const char *name)
if (strcmp(name,"body") == 0) return (void *) body;
if (strcmp(name,"quat") == 0) return (void *) quat;
// PERI PACKAGE
if (strcmp(name,"vfrac") == 0) return (void *) vfrac;
if (strcmp(name,"s0") == 0) return (void *) s0;
if (strcmp(name,"x0") == 0) return (void *) x0;
// SPIN PACKAGE
if (strcmp(name,"sp") == 0) return (void *) sp;
// EFF and AWPMD packages
if (strcmp(name,"spin") == 0) return (void *) spin;
if (strcmp(name,"eradius") == 0) return (void *) eradius;
if (strcmp(name,"ervel") == 0) return (void *) ervel;
@ -2673,6 +2681,7 @@ void *Atom::extract(const char *name)
if (strcmp(name,"vforce") == 0) return (void *) vforce;
if (strcmp(name,"etag") == 0) return (void *) etag;
// SPH package
if (strcmp(name,"rho") == 0) return (void *) rho;
if (strcmp(name,"drho") == 0) return (void *) drho;
if (strcmp(name,"esph") == 0) return (void *) esph;