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Bots/Crawler - crazy Mulliken charge

Bots/Crawler - Density of states calculations

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Guests - MemRegister error

Bots/Crawler - COSMO-SMD Initialization (regarding solvent accessible surface area)

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Bots/Crawler - How to make geometry optimization calculation faster

Guests - DFT caculation fail to Calculation failed to converge, someone help please

Bots/Crawler - Profiling Nwchem 6.8 (with score-p)

Bots/Crawler - optimization in qmd problem

Bots/Crawler - Problem in import calc from NWChem/ECCE output file

Bots/Crawler - General Topics

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Guests - compiling nwchem-6.6 with infiniband

Bots/Crawler - On entry to DGEMM parameter number 3 had an illegal value

Guests - Simple dimer DFT calculation with diffuse basis set

Bots/Crawler - General ECCE Topics

Bots/Crawler - error ival=5

Bots/Crawler - reforming Gaussian user

Guests - more significant digits

Guests - gaussian cubes with multiple orbitals

Guests - Compiling NWChem 7

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Guests - Multiplicity problem

Bots/Crawler - edithistory

Bots/Crawler - NWChem 7.0.0 available for dowload

Bots/Crawler - Printing gradients for the scf hessian run

Bots/Crawler - Could NWCHEM carry out energy decomposition analysis like SAPT?

Guests - index

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Bots/Crawler - Running NWChem

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Bots/Crawler - General Topics

Xiongyan21 - index

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Guests - which graphic tools should I choose for the output result of NWchem?

Guests - How to draw dimer charge transfer graph

Guests - Error message in compiling nwchem with mpi

Bots/Crawler - binary on mac

Guests - issues in setting Torsion for Geometry Adjust Zcoord

Bots/Crawler - Running NWChem

Guests - NWChem 6.8.1 with MPI support on Ubuntu 18.04. Help?

Bots/Crawler - Problem with runnig Nwchem in Linux Mint 18

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Bots/Crawler - Problems with running MD tests

Guests - MemRegister error

Guests - ONE quantum atom moves away during prepare for a qmmm job

Bots/Crawler - Error: Python input_parse with "spring bond" constraint

Bots/Crawler - Compiling NWChem

Bots/Crawler - Problem in import calc from NWChem/ECCE output file

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Bots/Crawler - CCSD Optimization

Bots/Crawler - NWChem 6.1.1 and Intel MPI with MKL

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Bots/Crawler - On entry to DGEMM parameter number 3 had an illegal value

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Guests - Solved: Nwchem 6.3 running 2-5 times slower than 6.1.1

Bots/Crawler - On entry to DLASCL parameter number 5 had an illegal value

Bots/Crawler - Problem in import calc from NWChem/ECCE output file

Bots/Crawler - Single iteration and dummy convergence

Bots/Crawler - basis sets for relativistic NESC

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