|
|
|
|
| LEADER |
01000naa a22002652 4500 |
| 001 |
NLM151621721 |
| 003 |
DE-627 |
| 005 |
20231223060333.0 |
| 007 |
tu |
| 008 |
231223s2004 xx ||||| 00| ||eng c |
| 028 |
5 |
2 |
|a pubmed24n0506.xml
|
| 035 |
|
|
|a (DE-627)NLM151621721
|
| 035 |
|
|
|a (NLM)15491194
|
| 040 |
|
|
|a DE-627
|b ger
|c DE-627
|e rakwb
|
| 041 |
|
|
|a eng
|
| 100 |
1 |
|
|a Bhatia, S K
|e verfasserin
|4 aut
|
| 245 |
1 |
0 |
|a High-pressure adsorption capacity and structure of CO2 in carbon slit pores
|b theory and simulation
|
| 264 |
|
1 |
|c 2004
|
| 336 |
|
|
|a Text
|b txt
|2 rdacontent
|
| 337 |
|
|
|a ohne Hilfsmittel zu benutzen
|b n
|2 rdamedia
|
| 338 |
|
|
|a Band
|b nc
|2 rdacarrier
|
| 500 |
|
|
|a Date Completed 26.05.2006
|
| 500 |
|
|
|a Date Revised 19.10.2004
|
| 500 |
|
|
|a published: Print
|
| 500 |
|
|
|a Citation Status PubMed-not-MEDLINE
|
| 520 |
|
|
|a We present new simulation results for the packing of single-center and three-center models of carbon dioxide at high pressure in carbon slit pores. The former shows a series of packing transitions that are well described by our density functional theory model developed earlier. In contrast, these transitions are absent for the three-center model. Analysis of the simulation results shows that alternations of flat-lying molecules and rotated molecules can occur as the pore width is increased. The presence or absence of quadrupoles has negligible effect on these high-density structures
|
| 650 |
|
4 |
|a Journal Article
|
| 700 |
1 |
|
|a Tran, K
|e verfasserin
|4 aut
|
| 700 |
1 |
|
|a Nguyen, T X
|e verfasserin
|4 aut
|
| 700 |
1 |
|
|a Nicholson, D
|e verfasserin
|4 aut
|
| 773 |
0 |
8 |
|i Enthalten in
|t Langmuir : the ACS journal of surfaces and colloids
|d 1992
|g 20(2004), 22 vom: 26. Okt., Seite 9612-20
|w (DE-627)NLM098181009
|x 1520-5827
|7 nnns
|
| 773 |
1 |
8 |
|g volume:20
|g year:2004
|g number:22
|g day:26
|g month:10
|g pages:9612-20
|
| 912 |
|
|
|a GBV_USEFLAG_A
|
| 912 |
|
|
|a SYSFLAG_A
|
| 912 |
|
|
|a GBV_NLM
|
| 912 |
|
|
|a GBV_ILN_22
|
| 912 |
|
|
|a GBV_ILN_350
|
| 912 |
|
|
|a GBV_ILN_721
|
| 951 |
|
|
|a AR
|
| 952 |
|
|
|d 20
|j 2004
|e 22
|b 26
|c 10
|h 9612-20
|