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MSTor version 2013: A new version of the computer code for the multi-structural torsional anharmonicity, now with a coupled torsional potential

Tersimpan di:
Main Author: CPC, Mendeley
Other Authors: Zheng, Jingjing, Meana-Pañeda, Rubén, Truhlar, Donald G.
Format: Dataset
Terbitan: Mendeley , 2013
Subjects:
Physical Chemistry
Molecular Physics
Statistical Physics
Computational Physics
Thermodynamics
Online Access: https:/data.mendeley.com/datasets/4xn7xw3pvz
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Lihat Juga

  • MSTor: A program for calculating partition functions, free energies, enthalpies, entropies, and heat capacities of complex molecules including torsional anharmonicity
    oleh: CPC, Mendeley
    Terbitan: (2012)
  • Single particle calculations for a Woods–Saxon potential with triaxial deformations, and large Cartesian oscillator basis (new version code)
    oleh: CPC, Mendeley
    Terbitan: (2007)
  • A new version of the program for the generation of symmetry-adapted functions for molecular calculations
    oleh: CPC, Mendeley
    Terbitan: (1990)
  • AMYR 2: A new version of a computer program for pair potential calculation of molecular associations
    oleh: CPC, Mendeley
    Terbitan: (1998)
  • A new version of a program calculating the static interaction potential between an electron and a diatomic molecule
    oleh: CPC, Mendeley
    Terbitan: (1976)

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