FAQ¶
Software Usage¶
- Slow Startup of QuantumATK NanoLab
- Log file Time Stamps in Windows Under Cygwin
- Bonds Between Some Atoms are Missing
- Difference Between Pseudopotentials and Basis Sets in QuantumATK
- Importing Atomic Coordinates from Other Software in NanoLab
- Running QuantumATK Using SLURM and MPICH (3.1.1+)
- Running QuantumATK Under Cray MPI (aprun)
Technical¶
- System Requirements for Running QuantumATK Q-2019.12
- System Requirements for Running QuantumATK P-2019.06
- System Requirements for Running QuantumATK P-2019.03
- System Requirements for Running QuantumATK P-2019.06
- System Requirements for Running ATK/VNL 2017
- Running QuantumATK on a Virtual Machine
- How Many Atoms Can Be Computed with QuantumATK
- QuantumATK Parallelization
- Extremely Dark Atoms for VNL-2016 on Windows 7
- How Come the ATK-VNL Package is Larger than a Typical DFT Code
Error Messages¶
- UnicodeDecodeError: ASCII Codec Can’t Decode
- atkpython.exe Stopped Working
- License Error: (Internal: 147 Feature: ATKDFT)
- License Error: Access Denied
- Error Installing VC++ Runtime
- ATKError: Inverse(DZMatrix const&) : Could Not LU Factorize!
- ATKError: Bad Allocation
- There Is No Licenses Served by the License Server
- locale.Error: Unsupported Locale Setting
- ERROR: ‘dict’ object has no attribute ‘len’
- Can’t Allocate Memory for Array
- Not Enough Space to Allocate vblock
- Killed by Signal 9
- Pulay Mixing Inversion Failed. Using Only Last Step
- Runtime Terminates an Application
- Import error:.../_path.so: undefined symbol: _ZNSs4_Rep20_S_empty_rep_storageE
- ImportError: No Module Named
- White Builder or Viewer Background
- Failure to Initialize
- WARNING: Feature Not Licensed to Work on a Virtual Machine and is Ignored
- libGL Warning: 3D Driver Claims to Not Support 0x5b
- (Err:20) Feature Not Allowed to Run on a Virtual Machine
- (Err:19) Feature Not Allowed to Run on Terminal Server Clients
- (Err: 10) Hostid Does Not Match License
- (Err: 6) Unable to Read File
- glibc Detected ... Corrupted Double-Linked List
- (Err: 15) Unable to Connect to License Server
- (Err: 35) Feature Does Not Support Network Licensing
- ATKError: St9bad_alloc
- ATKError: Exceeded Maximum Number of Self-Consistent Iterations
- ImportError: Gtk* Backend Requires pygtk to Be Installed
- locale::facet::_S_create_c_locale Name Not Valid
- The Computed TB09 meta-GGA Exchange-Correlation Potential Diverged ...
- Could Not Find or Load the Qt Platform Plugin “xcb”
- (Err: 51) Unable to Use Network License as a Local License
- Back Engine Exception : Unable to Start License System
Licensing¶
- Cannot Run QuantumATK P-2019.03
- Basic License Troubleshooting
- Advanced License Troubleshooting
- Maintenance, Updates and Support
- Floating or Nodelocked Licenses
- NLLicenseError: Unable to Start the License System (Error Code 61)
- License and QuantumATK Upgrading
- Updating the License File
- License Server Cannot Be Started
- HostID Does Not Match License (Error Code 10)
- SSH License Server Access
- License for QuantumATK Parallel Run
- Restricting Access to a License Server
Installation Issues¶
- QuantumATK Slow Start on Windows
- libjpeg.so.62: Cannot Open Shared Object File: No Such File or Directory
- “Side-by-Side” Configuration Error
- QuantumATK Segmentation Fault (Linux)
- Command Not Found (Linux)
- Cannot Start QuantumATK From the Desktop Icon
- libpng12.so.0: Cannot Open Shared Object File
- libGL.so: Cannot Open Shared Object File
- Cannot Restore Segment Prot After Reloc: Permission Denied
- “Send To” Button Stops Working on Ubuntu
- QuantumATK Problems on Ubuntu
- GLIBC_2.4 Not Found
- Firewall Issues
- No Module Named ipy_user_conf
- Segmentation Fault QuantumATK Closes Down When Clicking an Icon
- libGLU.so.1: Cannot Open Shared Object File
- libgomp.so.1: Cannot Open Shared Object File: No Such File or Directory
- ImportError: DLL Load Failed: The Specified Procedure Could Not Be Found
- Could Not Find or Load the Qt Platform Plugin “xcb”
- Interactive Mode Prints Black on Black in Windows 8 and 10 (QuantumATK 2015)