Definition of NWChem. Meaning of NWChem. Synonyms of NWChem

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Definition of NWChem

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Meaning of NWChem from wikipedia

- NWChem is an ab initio com****tional chemistry software package which includes quantum chemical and molecular dynamics functionality. It was designed to...
- COLUMBUS CONQUEST CP2K Dalton DIRAC DP code FLEUR FreeON MADNESS MOPAC MPQC NWChem Octopus OpenMolcas P****C PSI PyQuante PySCF Quantum ESPRESSO (PWscf) RMG...
- library is incorporated into many quantum chemistry packages, including NWChem, MOLPRO, UTChem, MOLCAS, and TURBOMOLE. The GA library is also incorporated...
- surfaces...), set up and analyze ab-initio (Quantum Espresso, VASP, Abinit, NWChem...) or classical (LAMMPS, Towhee) simulations Nanoengineer-1 – developed...
- COLUMBUS CONQUEST CP2K Dalton DIRAC DP code FLEUR FreeON MADNESS MOPAC MPQC NWChem Octopus OpenMolcas P****C PSI PyQuante PySCF Quantum ESPRESSO (PWscf) RMG...
- the common programs of quantum and classical molecular modelling ORCA, NWChem, Firefly, CP2K and MDynaMix . The molecular mechanics calculations cover...
- No No No No MOLPRO Yes Yes Yes No Yes Yes Yes Yes Yes Yes No No No No No NWChem Yes Yes Yes No Yes Yes Yes Yes Yes Yes Yes No No No No Orca Yes* Yes* Yes...
- results from NWChem, Gaussian 94, Gaussian 98, and Gaussian 03 calculations run outside of the ECCE environment. Extensive web-based help. NWChem Molden Avogadro...
- Carlo simulation package to predict thermophysical properties of fluids NWChemQuantum chemical and molecular dynamics software Avogadro – Plugin-extensible...
- Un­known NESSIE Free, BSD v2 Fortran Yes Yes Un­known Un­known Un­known NWChem Free, ECL v2 Fortran 77, C Yes Yes Yes, CUDA Un­known Un­known Octopus Free...