Translations:Computational chemistry/9/fr: Difference between revisions

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* [[ABINIT]]
* [[ABINIT/fr|ABINIT]]
* [http://www.cp2k.org/ CP2K]  
* [[ADF/fr|ADF]]/[[AMS/fr|AMS]]
* [http://cpmd.org CPMD]
* [[AMBER/fr|AMBER]]
* [[CP2K/fr|CP2K]]  
* [[CPMD/fr|CPMD]]
* [[Dalton/fr|Dalton]]
* [http://www.demon-software.com/public_html/program.html deMon]
* [http://www.demon-software.com/public_html/program.html deMon]
* [http://www.scd.stfc.ac.uk/SCD/44516.aspx DL_POLY]
* [[DL_POLY/fr|DL_POLY]]
* [http://www.msg.chem.iastate.edu/gamess/index.html GAMESS-US]
* [[GAMESS-US/fr|GAMESS-US]]
* [[Gaussian/fr|Gaussian]]  
* [[Gaussian/fr|Gaussian]]
* [[GPAW/fr|GPAW]] 
* [[GROMACS/fr|GROMACS]]
* [[GROMACS/fr|GROMACS]]
* [http://lammps.sandia.gov/ LAMMPS]
* [http://glotzerlab.engin.umich.edu/hoomd-blue/ HOOMD-blue]
* [[LAMMPS/fr|LAMMPS]]
* [[MRCC/fr|MRCC]]
* [[NAMD/fr|NAMD]]
* [[NAMD/fr|NAMD]]
* [https://nbo7.chem.wisc.edu/ NBO] est inclus dans plusieurs de nos modules [[Gaussian/fr#Remarques|Gaussian]].
* [http://www.nwchem-sw.org NWChem]
* [http://www.nwchem-sw.org NWChem]
* [https://openkim.org/ OpenKIM]
* [https://openkim.org/ OpenKIM]
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* [http://departments.icmab.es/leem/siesta SIESTA]
* [http://departments.icmab.es/leem/siesta SIESTA]
* [[VASP/fr|VASP]]
* [[VASP/fr|VASP]]
* [https://www.chemie.uni-bonn.de/pctc/mulliken-center/software/xtb XTB (Extended Tight Binding)]

Latest revision as of 20:37, 1 May 2024

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Message definition (Computational chemistry)
* [[ABINIT]]
* [[ADF]]/[[AMS]]
* [[AMBER]]
* [[CP2K]] 
* [[CPMD]]
* [[Dalton]]
* [http://www.demon-software.com/public_html/program.html deMon]
* [[DL_POLY]]
* [[GAMESS-US]] 
* [[Gaussian]]
* [[GPAW]] 
* [[GROMACS]]
* [http://glotzerlab.engin.umich.edu/hoomd-blue/ HOOMD-blue]
* [[LAMMPS]]
* [[MRCC]]
* [[NAMD]]
* [https://nbo7.chem.wisc.edu/ NBO] is included in several of our [[Gaussian#Notes|Gaussian]] modules.
* [http://www.nwchem-sw.org NWChem]
* [https://openkim.org/ OpenKIM]
* [https://simtk.org/home/openmm OpenMM]
* [[ORCA]]
* [http://www.plumed-code.org PLUMED]
* [http://www.psicode.org/ PSI4]
* [[Quantum ESPRESSO]]
* [https://www.rosettacommons.org Rosetta]
* [http://departments.icmab.es/leem/siesta SIESTA]
* [[VASP]]
* [https://www.chemie.uni-bonn.de/pctc/mulliken-center/software/xtb XTB (Extended Tight Binding)]
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