| 查看: 64 | 回复: 0 | |||
| 当前主题已经存档。 | |||
[交流]
【求助】这个错误怎么解决？
|
|||
|
我用的discover 模块，加入电场后，出现了这样的错误提示 Error: Column "Fractional2Cartesian" not found in Table "Cell". Defined Column identifiers are: System*Cell Periodicity AtomTable BondTable while executing "$hh get f2c Cell.Fractional2Cartesian" (procedure "sysCellVol" line 4) invoked from within "sysCellVol" invoked from within "set v [sysCellVol]..." (procedure "polarization" line 12) invoked from within "polarization" invoked from within "set p [polarization]..." invoked from within "dynamics time = $duration timestep = 1.0 -boltzmann ensemble = nvt temperature_control_method = andersen integration_method = Velocity_verlet coll ..." (procedure "dynamicsStageEF" line 18) invoked from within "dynamicsStageEF $duration $temp $np_samples $ave_intvl " invoked from within "set ave_pol [dynamicsStageEF $duration $temp $np_samples $ave_intvl ]..." ("for" body line 15) invoked from within "for {set stage_num 1} {$stage_num <= $nstage} {incr stage_num} { set xx [expr $xdir * $strength] set yy [expr $ydir * $strength] set zz [ ..." (procedure "Electric_Field" line 112) invoked from within "Electric_Field 298 0 0 1 1e+007 1e+009 3 1000 50 100 1 0" 请高手解释一下 |
回复此楼» 猜你喜欢
博士读完未来一定会好吗
已经有23人回复
-
导师想让我从独立一作变成了共一第一
已经有7人回复
-
到新单位后，换了新的研究方向，没有团队，持续积累2区以上论文，能申请到面上吗
已经有11人回复
-
读博
已经有4人回复
-
JMPT 期刊投稿流程
已经有4人回复
-
心脉受损
已经有5人回复
-
Springer期刊投稿求助
已经有4人回复
-
小论文投稿
已经有3人回复
-
申请2026年博士
已经有6人回复
