| 1. |
- Baudin, M, et al.
(author)
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A molecular dynamics study of MgO(111) slabs
- 1997
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In: SURFACE SCIENCE. - : ELSEVIER SCIENCE BV. - 0039-6028. ; 375:2-3, s. 374-384
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Journal article (other academic/artistic)abstract
- Constant stress - constant temperature molecular dynamics simulations are reported for 30 Angstrom thick crystalline MgO (111) slabs with 2-D periodicity in the temperature range 10-1100 K. The 10 K run was 3.75 ps, the 300 K run was 41.25 ps while the ot
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| 2. |
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| 3. |
- Hermansson, K, et al.
(author)
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Water exchange around Li+ and Na+ in LiCl(aq) and NaCl(aq) from MD simulations
- 1998
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In: JOURNAL OF PHYSICAL CHEMISTRY B. - : AMER CHEMICAL SOC. - 1089-5647. ; 102:31, s. 6089-6097
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Journal article (other academic/artistic)abstract
- The solvent exchange mechanisms around alkali cations in dilute aqueous solution have been investigated from cation-oxygen distance vs time curves, molecular animations, activation volumes, and lifetime statistics. Constant pressure (0 atm)-constant tempe
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| 4. |
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| 5. |
- Wojcik, MC, et al.
(author)
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The problem of the detaching shell in the shell model potential for oxides
- 1998
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In: CHEMICAL PHYSICS LETTERS. - : ELSEVIER SCIENCE BV. - 0009-2614. ; 289:1-2, s. 211-218
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Journal article (other academic/artistic)abstract
- Many sets of shell model parameters for oxides suffer from the defect that when the anion-cation pair is not restrained by the normal lattice forces, the ions collapse into each other. This can degrade their usefulness in the study of, for example, solid
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| 6. |
- Zima, J, et al.
(author)
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The list of the chromosome races of the common shrew (Sorex araneus)
- 1996
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In: HEREDITAS. - : HEREDITAS-DISTRIBUTION. - 0018-0661. ; 125:2-3, s. 97-107
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Journal article (other academic/artistic)abstract
- The list of chromosome races of the common shrew (Sorex araneus) was compiled, the vast literature has been scrutinized, and unpublished data have been added. Altogether, 50 chromosome races could be listed. The name and its synonyms, chromosomal constitu
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