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tweak settings for thermo style "one"

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This commit is contained in:
Axel Kohlmeyer
2022-03-21 14:44:07 -04:00
parent 6c30bdf082
commit 4c1a6d7ecf
1 changed files with 3 additions and 3 deletions
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6
src/thermo.cpp
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@ -71,8 +71,8 @@ using namespace MathConst;
enum { ONELINE, MULTILINE, YAMLLINE };
// style "one"
static constexpr char ONE[] = "step temp epair emol etotal press";
#define FORMAT_FLOAT_ONE_DEFAULT "%12.8g"
#define FORMAT_INT_ONE_DEFAULT "%10d"
#define FORMAT_FLOAT_ONE_DEFAULT "% -12.8g"
#define FORMAT_INT_ONE_DEFAULT "%10d "
// style "multi"
static constexpr char MULTI[] =
"etotal ke temp pe ebond eangle edihed eimp evdwl ecoul elong press";
@ -328,7 +328,7 @@ void Thermo::header()
if (vtype[i] == FLOAT)
hdr += fmt::format("{:^12} ", keyword[i]);
else if ((vtype[i] == INT) || (vtype[i] == BIGINT))
hdr += fmt::format("{:^10} ", keyword[i]);
hdr += fmt::format("{:^11} ", keyword[i]);
} else if (lineflag == YAMLLINE) {
hdr += keyword[i];
hdr += ", ";