Abstract
An X-ray diffraction measurement has been carried out for a 3.9 mol% aqueous solution of TBA (tertiary butylalcohol) with an energy-dispersive diffractometer. Constant temperature molecular dynamics calculation has also been made for an aqueous solution model simulating the above-mentioned mixture. Both results suggest the formation of a fairly stable clathrate-like structure of water around TBA molecules.
| Original language | English |
|---|---|
| Pages (from-to) | 119-126 |
| Number of pages | 8 |
| Journal | Journal of Inclusion Phenomena and Macrocyclic Chemistry |
| Volume | 2 |
| Issue number | 1-2 |
| DOIs | |
| Publication status | Published - Mar 1984 |
| Externally published | Yes |
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ASJC Scopus subject areas
- Condensed Matter Physics
- Chemistry(all)
Cite this
Clathrate-like structure of water around some nonelectrolytes in dilute solution as revealed by computer simulation and X-ray diffraction studies. / Tanaka, Hideki; Nakanishi, Koichiro; Nishikawa, Keiko.
In: Journal of Inclusion Phenomena and Macrocyclic Chemistry, Vol. 2, No. 1-2, 03.1984, p. 119-126.Research output: Contribution to journal › Article
}
TY - JOUR
T1 - Clathrate-like structure of water around some nonelectrolytes in dilute solution as revealed by computer simulation and X-ray diffraction studies
AU - Tanaka, Hideki
AU - Nakanishi, Koichiro
AU - Nishikawa, Keiko
PY - 1984/3
Y1 - 1984/3
N2 - An X-ray diffraction measurement has been carried out for a 3.9 mol% aqueous solution of TBA (tertiary butylalcohol) with an energy-dispersive diffractometer. Constant temperature molecular dynamics calculation has also been made for an aqueous solution model simulating the above-mentioned mixture. Both results suggest the formation of a fairly stable clathrate-like structure of water around TBA molecules.
AB - An X-ray diffraction measurement has been carried out for a 3.9 mol% aqueous solution of TBA (tertiary butylalcohol) with an energy-dispersive diffractometer. Constant temperature molecular dynamics calculation has also been made for an aqueous solution model simulating the above-mentioned mixture. Both results suggest the formation of a fairly stable clathrate-like structure of water around TBA molecules.
UR - http://www.scopus.com/inward/record.url?scp=0013670954&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=0013670954&partnerID=8YFLogxK
U2 - 10.1007/BF00663247
DO - 10.1007/BF00663247
M3 - Article
AN - SCOPUS:0013670954
VL - 2
SP - 119
EP - 126
JO - Journal of Inclusion Phenomena and Macrocyclic Chemistry
JF - Journal of Inclusion Phenomena and Macrocyclic Chemistry
SN - 1388-3127
IS - 1-2
ER -