Last update: Sun Jun 2 02:01:03 MDT 2019
Top |
Symbols |
Math |
A |
B |
C |
D |
E |
F |
G |
H |
I |
J |
K |
L |
M |
N |
O |
P |
Q |
R |
S |
T |
U |
V |
W |
X |
Y |
Z
BibTeX entry
@Article{Gonzalez:1997:HLI,
author = "Leticia Gonz{\'a}lez and Otilia M{\'o} and Manuel
Y{\'a}{\~n}ez",
title = "High-level ab initio versus {DFT} calculations on
{(H$_2$O$_2$)$_2$} and {H$_2$O$_2$--H$_2$O} complexes
as prototypes of multiple hydrogen bond systems",
journal = j-J-COMPUT-CHEM,
volume = "18",
number = "9",
pages = "1124--1135",
day = "15",
month = jul,
year = "1997",
CODEN = "JCCHDD",
DOI = "https://doi.org/10.1002/(SICI)1096-987X(19970715)18:9<1124::AID-JCC2>3.0.CO;2-T",
ISSN = "0192-8651 (print), 1096-987X (electronic)",
ISSN-L = "0192-8651",
bibdate = "Thu Nov 29 15:11:14 MST 2012",
bibsource = "http://www.interscience.wiley.com/jpages/0192-8651;
http://www.math.utah.edu/pub/tex/bib/jcomputchem1990.bib",
acknowledgement = ack-nhfb,
fjournal = "Journal of Computational Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0192-8651",
onlinedate = "7 Dec 1998",
}
Related entries
- $_2$,
11(1)1,
11(5)576,
11(7)765,
11(8)924,
12(1)52,
12(5)565,
12(6)705,
12(6)717,
12(9)1047,
12(10)1237,
13(2)142,
13(4)423,
13(6)718,
13(9)1037,
13(9)1066,
14(11)1326,
14(12)1491,
15(3)346,
15(10)1176,
15(12)1341,
16(4)465,
16(5)576,
16(6)768,
16(8)1027,
17(1)42,
17(7)821,
17(7)835,
17(8)919,
17(9)1163,
17(11)1339,
18(9)1167,
18(14)1792,
19(11)1205,
19(15)1698,
20(1)70,
20(8)772,
20(10)989,
20(11)1138,
20(12)1281,
20(13)1343,
20(13)1432
- bond,
11(3)396,
11(8)952,
11(10)1160,
11(10)1217,
12(5)546,
12(6)690,
12(6)697,
12(6)742,
13(4)399,
13(6)722,
13(7)860,
13(7)912,
13(10)1184,
14(4)379,
14(4)471,
14(5)556,
14(8)881,
14(12)1553,
15(2)183,
15(3)313,
15(5)553,
15(6)644,
15(9)919,
15(10)1091,
15(12)1357,
15(12)1365,
16(10)1227,
17(2)133,
17(3)313,
17(5)747,
18(9)1245,
18(12)1513,
18(13)1664,
18(16)2075,
19(2)154,
19(2)181,
19(6)610,
19(8)935,
19(8)947,
19(12)1345,
20(8)760,
20(10)1067,
20(10)1085,
20(13)1444,
20(14)1517,
20(15)1644
- complex,
11(1)1,
11(2)242,
11(3)326,
11(9)1061,
11(10)1217,
12(1)1,
12(7)899,
12(8)923,
12(8)994,
13(1)76,
14(1)37,
14(6)699,
14(8)899,
14(8)961,
14(12)1561,
15(7)704,
15(9)1013,
15(10)1074,
16(1)131,
16(5)534,
16(7)843,
16(8)1027,
16(10)1210,
17(3)338,
17(8)919,
17(13)1520,
17(14)1624,
17(15)1712,
18(1)45,
18(6)723,
18(15)1848,
18(15)1863,
19(2)139,
19(8)820,
19(8)902,
19(8)912,
19(10)1167,
20(3)287,
20(5)511,
20(9)911,
20(9)956,
20(12)1254,
20(13)1379,
20(13)1391,
20(16)1685
- DFT,
15(10)1053,
18(5)694,
19(6)575,
19(12)1345,
20(1)91,
20(12)1304
- H,
11(1)1,
11(5)576,
12(1)139,
12(5)565,
12(6)705,
12(9)1047,
12(10)1237,
13(4)423,
13(6)792,
13(9)1037,
14(3)285,
14(11)1326,
14(12)1491,
15(4)377,
15(7)733,
16(4)465,
16(6)768,
16(8)1027,
17(7)905,
17(9)1099,
17(9)1163,
18(1)9,
18(9)1167,
18(14)1792,
19(15)1698,
20(9)911,
20(11)1138,
20(12)1220,
20(12)1281,
20(13)1412,
20(13)1432,
20(15)1671
- hydrogen,
11(1)1,
11(2)170,
11(7)837,
11(10)1217,
12(5)584,
13(4)399,
13(6)722,
13(7)851,
13(7)860,
13(8)963,
13(8)971,
13(9)1151,
14(1)89,
14(3)285,
14(6)639,
14(9)1027,
14(12)1534,
15(2)183,
15(5)553,
17(2)133,
17(15)1712,
17(16)1804,
18(6)757,
18(9)1245,
18(14)1695,
18(16)2060,
19(3)277,
19(9)1001,
19(9)1072,
19(12)1345,
20(12)1262
- Mó, Otilia,
16(3)263
- multiple,
13(1)66,
13(5)579,
13(8)944,
15(9)1041,
18(14)1785,
19(13)1534
- system,
0(0)xvii--493,
11(1)112,
11(2)194,
11(2)266,
11(4)440,
11(5)545,
11(5)576,
11(6)754,
11(7)805,
12(3)369,
12(5)565,
12(5)611,
12(6)751,
12(7)899,
13(4)468,
13(4)525,
13(5)570,
13(7)830,
14(6)680,
14(6)728,
14(8)895,
14(8)944,
14(9)1027,
14(10)1136,
14(10)1149,
14(11)1272,
14(11)1347,
14(12)1446,
15(3)269,
15(5)524,
15(8)847,
15(10)1113,
15(10)1121,
15(10)1163,
15(11)1217,
16(3)311,
16(4)445,
16(6)758,
16(6)768,
16(7)898,
16(8)984,
16(9)1131,
16(10)1238,
16(12)1522,
16(12)1543,
16(12)1554,
17(2)204,
17(3)326,
17(8)940,
17(8)954,
17(11)1287,
17(13)1497,
18(1)70,
18(1)115,
18(3)381,
18(4)463,
18(4)501,
18(12)1513,
18(13)1570,
18(15)1848,
18(15)1903,
19(16)1887,
20(5)531,
20(8)786,
20(8)857,
20(10)989,
20(12)1274
- versus,
15(5)479,
16(12)1449,
17(9)1112,
18(5)660
- Yáñez, Manuel,
16(3)263