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Hô, Minhhuy, Sagar, Robin P., Pérez-Jordá, José M., Smith, Vedene H., Esquivel, Rodolfo O. (1994) A numerical study of molecular information entropies. Chemical Physics Letters, 219. 15-20 doi:10.1016/0009-2614(94)00029-8

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Reference TypeJournal (article/letter/editorial)
TitleA numerical study of molecular information entropies
JournalChemical Physics Letters
AuthorsHô, MinhhuyAuthor
Sagar, Robin P.Author
Pérez-Jordá, José M.Author
Smith, Vedene H.Author
Esquivel, Rodolfo O.Author
Year1994 (March)Volume219
PublisherElsevier BV
DOIdoi:10.1016/0009-2614(94)00029-8Search in ResearchGate
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Mindat Ref. ID5890686Long-form Identifiermindat:1:5:5890686:0
GUID0
Full ReferenceHô, Minhhuy, Sagar, Robin P., Pérez-Jordá, José M., Smith, Vedene H., Esquivel, Rodolfo O. (1994) A numerical study of molecular information entropies. Chemical Physics Letters, 219. 15-20 doi:10.1016/0009-2614(94)00029-8
Plain TextHô, Minhhuy, Sagar, Robin P., Pérez-Jordá, José M., Smith, Vedene H., Esquivel, Rodolfo O. (1994) A numerical study of molecular information entropies. Chemical Physics Letters, 219. 15-20 doi:10.1016/0009-2614(94)00029-8
In(n.d.) Chemical Physics Letters Vol. 219. Elsevier BV

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Esquivel, Rodolfo O., Rodríguez, Ana L., Sagar, Robin P., Hô, Minhhuy, Smith, Vedene H. (1996) Physical interpretation of information entropy: Numerical evidence of the Collins conjecture. Physical Review A, 54 (1). 259-265 doi:10.1103/physreva.54.259
Hồ, Minhhuy, Smith, Vedene H., Weaver, Donald F., Gatti, Carlo, Sagar, Robin P., Esquivel, Rodolfo O. (1998) Molecular similarity based on information entropies and distances. The Journal of Chemical Physics, 108 (13). 5469-5475 doi:10.1063/1.476316
Sagar, Robin P., Ramírez, Juan Carlos, Esquivel, Rodolfo O., Hô, Minhhuy, Smith, Vedene H. (2001) Shannon entropies and logarithmic mean excitation energies from cusp- and asymptotic-constrained model densities. Physical Review A, 63 (2). doi:10.1103/physreva.63.022509
Ramírez, Juan Carlos, Pérez, Julio Manuel Hernández, Sagar, Robin P., Esquivel, Rodolfo O., Hô, Minhhuy, Smith, Vedene H. (1998) Amount of information present in the one-particle density matrix and the charge density. Physical Review A, 58 (5). 3507-3515 doi:10.1103/physreva.58.3507
HÔ, MINHHUY, SMITH, VEDENE H., SAGAR, ROBIN P., ESQIVEL, RODOLFO O. (2001) Asymptotic behaviour of the ratio of density gradient to electron density for atomic systems. Molecular Physics, 99. 1727-1728 doi:10.1080/00268970110051695
Sagar, Robin P., Ramı́rez, Juan Carlos, Esquivel, Rodolfo O., Hô, Minhhuy, Smith, Vedene H. (2002) Relationships between Jaynes entropy of the one-particle density matrix and Shannon entropy of the electron densities. The Journal of Chemical Physics, 116 (21). 9213-9221 doi:10.1063/1.1473806
Hồ, Minhhuy, Weaver, Donald F., Smith, Vedene H., Sagar, Robin P., Esquivel, Rodolfo O., Yamamoto, Shigeyoshi (1998) An information-entropic study of correlated densities of the water molecule. The Journal of Chemical Physics, 109 (24). 10620-10627 doi:10.1063/1.477761
Hồ, Minhhuy, Clark, B. James, Smith, Vedene H., Weaver, Donald F., Gatti, Carlo, Sagar, Robin P., Esquivel, Rodolfo O. (2000) Shannon information entropies of molecules and functional groups in the self-consistent reaction field. The Journal of Chemical Physics, 112 (17). 7572-7580 doi:10.1063/1.481366
Ramírez, Juan Carlos, Soriano, Catalina, Esquivel, Rodolfo O., Sagar, Robin P., Ho⁁, Minhhuy, Smith, Vedene H. (1997) Jaynes information entropy of small molecules: Numerical evidence of the Collins conjecture. Physical Review A, 56 (6). 4477-4482 doi:10.1103/physreva.56.4477
Hồ, Minhhuy, Weaver, Donald F., Smith, Vedene H., Sagar, Robin P., Esquivel, Rodolfo O. (1998) Calculating the logarithmic mean excitation energy from the Shannon information entropy of the electronic charge density. Physical Review A, 57 (6). 4512-4517 doi:10.1103/physreva.57.4512
Esquivel, Rodolfo O., Sagar, Robin P., Smith, Vedene H., Chen, Jiqiang, Stott, M. J. (1993) Pseudoconvexity of the atomic electron density: A numerical study. Physical Review A, 47 (6). 4735-4748 doi:10.1103/physreva.47.4735
 
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