Messages

1

General Questions and Answers / Re: Jobs Manager: Failed to invoke an add-on (AddOn: DirectRemotePluggin)

« on: March 7, 2018, 15:29 »

Could you please export the machine settings to a file and send it to support@quantumwise.com? Please also include information about which version of VNL you are using.

Many Thanks for your suggestion.

How can I export the machine settings (the remote one or the local one) or I just take snapshots? 

2

General Questions and Answers / Jobs Manager: Failed to invoke an add-on (AddOn: DirectRemotePluggin)

« on: March 6, 2018, 20:43 »

Dear All

I have tried to setup a local machine to run on a remote machine. Everything on https://docs.quantumwise.com/tutorials/job_manager_remote/job_manager_remote.html is checked and my diagnostics run green. However. when I try to run a job, the error message says:

Error message:
can only concatenate tuple (not "list") to tuple

Traceback (most recent call last):
  File "zipdir\NL\GUI\Plugin\Utilities.py", line 73, in pluginCaller
  File "C:\Program Files (x86)\QuantumWise\VNL-ATK-2017.2\Lib\site-packages\AddOns\JobManager\RemotePlugin\RemotePlugin.py", line 260, in createJobItem
    job = self.createJob(script, job_properties)
  File "C:\Program Files (x86)\QuantumWise\VNL-ATK-2017.2\Lib\site-packages\AddOns\JobManager\RemotePlugin\RemotePlugin.py", line 392, in createJob
    tasks += self.prepareTasks(variables, ssh_connection)
  File "C:\Program Files (x86)\QuantumWise\VNL-ATK-2017.2\Lib\site-packages\AddOns\JobManager\RemotePlugin\RemotePlugin.py", line 553, in prepareTasks
    script=quote(self.submissionScript(variables)),
  File "C:\Program Files (x86)\QuantumWise\VNL-ATK-2017.2\Lib\site-packages\AddOns\JobManager\DirectRemotePlugin\DirectRemotePlugin.py", line 209, in submissionScript
    'MKL_DYNAMIC=%s' % str(variables['mkl_dynamic']).upper()
TypeError: can only concatenate tuple (not "list") to tuple

3

General Questions and Answers / The r_13 parameter in Stiwe3Potential

« on: February 9, 2018, 03:35 »

Dear ATK Users

For the cutoff parameter in Stiwe3Potential (https://docs.quantumwise.com/manuals/Types/Stiwe3Potential/Stiwe3Potential.html), r_0 and r_1 are the two cutoff distances for the 3-body contribution, I am confused what is r_13?

Best
Lunna