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A MOLECULAR-DYNAMICS STUDY OF LIQUID METHANOL WITH A FLEXIBLE 3-SITE MODEL
被引:174
作者
:
PALINKAS, G
论文数:
0
引用数:
0
h-index:
0
机构:
MAX PLANCK INST CHEM,OTTO HAHN INST,D-6500 MAINZ,FED REP GER
MAX PLANCK INST CHEM,OTTO HAHN INST,D-6500 MAINZ,FED REP GER
PALINKAS, G
[
1
]
HAWLICKA, E
论文数:
0
引用数:
0
h-index:
0
机构:
MAX PLANCK INST CHEM,OTTO HAHN INST,D-6500 MAINZ,FED REP GER
MAX PLANCK INST CHEM,OTTO HAHN INST,D-6500 MAINZ,FED REP GER
HAWLICKA, E
[
1
]
HEINZINGER, K
论文数:
0
引用数:
0
h-index:
0
机构:
MAX PLANCK INST CHEM,OTTO HAHN INST,D-6500 MAINZ,FED REP GER
MAX PLANCK INST CHEM,OTTO HAHN INST,D-6500 MAINZ,FED REP GER
HEINZINGER, K
[
1
]
机构
:
[1]
MAX PLANCK INST CHEM,OTTO HAHN INST,D-6500 MAINZ,FED REP GER
来源
:
JOURNAL OF PHYSICAL CHEMISTRY
|
1987年
/ 91卷
/ 16期
关键词
:
D O I
:
10.1021/j100300a026
中图分类号
:
O64 [物理化学(理论化学)、化学物理学];
学科分类号
:
070304 ;
081704 ;
摘要
:
引用
收藏
页码:4334 / 4341
页数:8
相关论文
共 35 条
[1]
ATKINS PW, 1982, PHYSICAL CHEM
[2]
THERMODYNAMICS AND QUANTUM CORRECTIONS FROM MOLECULAR-DYNAMICS FOR LIQUID WATER
BERENS, PH
论文数:
0
引用数:
0
h-index:
0
BERENS, PH
MACKAY, DHJ
论文数:
0
引用数:
0
h-index:
0
MACKAY, DHJ
WHITE, GM
论文数:
0
引用数:
0
h-index:
0
WHITE, GM
WILSON, KR
论文数:
0
引用数:
0
h-index:
0
WILSON, KR
[J].
JOURNAL OF CHEMICAL PHYSICS,
1983,
79
(05)
: 2375
-
2389
[3]
AN IMPROVED POTENTIAL FOR NON-RIGID WATER-MOLECULES IN THE LIQUID-PHASE
BOPP, P
论文数:
0
引用数:
0
h-index:
0
BOPP, P
JANCSO, G
论文数:
0
引用数:
0
h-index:
0
JANCSO, G
HEINZINGER, K
论文数:
0
引用数:
0
h-index:
0
HEINZINGER, K
[J].
CHEMICAL PHYSICS LETTERS,
1983,
98
(02)
: 129
-
133
[4]
A STUDY OF THE VIBRATIONAL MOTIONS OF WATER IN AN AQUEOUS CACL2 SOLUTION
BOPP, P
论文数:
0
引用数:
0
h-index:
0
BOPP, P
[J].
CHEMICAL PHYSICS,
1986,
106
(02)
: 205
-
212
[5]
IMPROVED POTENTIAL FUNCTIONS FOR BENT AB2 MOLECULES - WATER AND OZONE
CARNEY, GD
论文数:
0
引用数:
0
h-index:
0
机构:
BATTELLE MEM INST COLUMBUS LABS,COLUMBUS,OH 43201
BATTELLE MEM INST COLUMBUS LABS,COLUMBUS,OH 43201
CARNEY, GD
CURTISS, LA
论文数:
0
引用数:
0
h-index:
0
机构:
BATTELLE MEM INST COLUMBUS LABS,COLUMBUS,OH 43201
BATTELLE MEM INST COLUMBUS LABS,COLUMBUS,OH 43201
CURTISS, LA
LANGHOFF, SR
论文数:
0
引用数:
0
h-index:
0
机构:
BATTELLE MEM INST COLUMBUS LABS,COLUMBUS,OH 43201
BATTELLE MEM INST COLUMBUS LABS,COLUMBUS,OH 43201
LANGHOFF, SR
[J].
JOURNAL OF MOLECULAR SPECTROSCOPY,
1976,
61
(03)
: 371
-
381
[6]
FALK M, 1961, J CHEM PHYS, V34, P1555
[7]
Fujimori H., 1981, Memoirs of the Faculty of Engineering, Hokkaido University, V15, P395
[8]
ASPECTS OF THE PERCOLATION PROCESS FOR HYDROGEN-BOND NETWORKS IN WATER
GEIGER, A
论文数:
0
引用数:
0
h-index:
0
机构:
BELL TEL LABS INC,MURRAY HILL,NJ 07974
GEIGER, A
STILLINGER, FH
论文数:
0
引用数:
0
h-index:
0
机构:
BELL TEL LABS INC,MURRAY HILL,NJ 07974
STILLINGER, FH
RAHMAN, A
论文数:
0
引用数:
0
h-index:
0
机构:
BELL TEL LABS INC,MURRAY HILL,NJ 07974
RAHMAN, A
[J].
JOURNAL OF CHEMICAL PHYSICS,
1979,
70
(09)
: 4185
-
4193
[9]
PAIR INTERACTIONS AND HYDROGEN-BOND NETWORKS IN MODELS OF LIQUID METHANOL
HAUGHNEY, M
论文数:
0
引用数:
0
h-index:
0
机构:
CNR,IST FIS ATOM & MOLEC,I-56100 PISA,ITALY
CNR,IST FIS ATOM & MOLEC,I-56100 PISA,ITALY
HAUGHNEY, M
FERRARIO, M
论文数:
0
引用数:
0
h-index:
0
机构:
CNR,IST FIS ATOM & MOLEC,I-56100 PISA,ITALY
CNR,IST FIS ATOM & MOLEC,I-56100 PISA,ITALY
FERRARIO, M
MCDONALD, IR
论文数:
0
引用数:
0
h-index:
0
机构:
CNR,IST FIS ATOM & MOLEC,I-56100 PISA,ITALY
CNR,IST FIS ATOM & MOLEC,I-56100 PISA,ITALY
MCDONALD, IR
[J].
MOLECULAR PHYSICS,
1986,
58
(04)
: 849
-
853
[10]
MOLECULAR-DYNAMICS SIMULATION OF AN AQUEOUS NACLO4 SOLUTION
HEINJE, G
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MARBURG,PHYS CHEM,HANS MEERWEIN STR,D-3550 MARBURG,FED REP GER
HEINJE, G
LUCK, WAP
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MARBURG,PHYS CHEM,HANS MEERWEIN STR,D-3550 MARBURG,FED REP GER
LUCK, WAP
HEINZINGER, K
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MARBURG,PHYS CHEM,HANS MEERWEIN STR,D-3550 MARBURG,FED REP GER
HEINZINGER, K
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1987,
91
(02)
: 331
-
338
←
1
2
3
4
→
共 35 条
[1]
ATKINS PW, 1982, PHYSICAL CHEM
[2]
THERMODYNAMICS AND QUANTUM CORRECTIONS FROM MOLECULAR-DYNAMICS FOR LIQUID WATER
BERENS, PH
论文数:
0
引用数:
0
h-index:
0
BERENS, PH
MACKAY, DHJ
论文数:
0
引用数:
0
h-index:
0
MACKAY, DHJ
WHITE, GM
论文数:
0
引用数:
0
h-index:
0
WHITE, GM
WILSON, KR
论文数:
0
引用数:
0
h-index:
0
WILSON, KR
[J].
JOURNAL OF CHEMICAL PHYSICS,
1983,
79
(05)
: 2375
-
2389
[3]
AN IMPROVED POTENTIAL FOR NON-RIGID WATER-MOLECULES IN THE LIQUID-PHASE
BOPP, P
论文数:
0
引用数:
0
h-index:
0
BOPP, P
JANCSO, G
论文数:
0
引用数:
0
h-index:
0
JANCSO, G
HEINZINGER, K
论文数:
0
引用数:
0
h-index:
0
HEINZINGER, K
[J].
CHEMICAL PHYSICS LETTERS,
1983,
98
(02)
: 129
-
133
[4]
A STUDY OF THE VIBRATIONAL MOTIONS OF WATER IN AN AQUEOUS CACL2 SOLUTION
BOPP, P
论文数:
0
引用数:
0
h-index:
0
BOPP, P
[J].
CHEMICAL PHYSICS,
1986,
106
(02)
: 205
-
212
[5]
IMPROVED POTENTIAL FUNCTIONS FOR BENT AB2 MOLECULES - WATER AND OZONE
CARNEY, GD
论文数:
0
引用数:
0
h-index:
0
机构:
BATTELLE MEM INST COLUMBUS LABS,COLUMBUS,OH 43201
BATTELLE MEM INST COLUMBUS LABS,COLUMBUS,OH 43201
CARNEY, GD
CURTISS, LA
论文数:
0
引用数:
0
h-index:
0
机构:
BATTELLE MEM INST COLUMBUS LABS,COLUMBUS,OH 43201
BATTELLE MEM INST COLUMBUS LABS,COLUMBUS,OH 43201
CURTISS, LA
LANGHOFF, SR
论文数:
0
引用数:
0
h-index:
0
机构:
BATTELLE MEM INST COLUMBUS LABS,COLUMBUS,OH 43201
BATTELLE MEM INST COLUMBUS LABS,COLUMBUS,OH 43201
LANGHOFF, SR
[J].
JOURNAL OF MOLECULAR SPECTROSCOPY,
1976,
61
(03)
: 371
-
381
[6]
FALK M, 1961, J CHEM PHYS, V34, P1555
[7]
Fujimori H., 1981, Memoirs of the Faculty of Engineering, Hokkaido University, V15, P395
[8]
ASPECTS OF THE PERCOLATION PROCESS FOR HYDROGEN-BOND NETWORKS IN WATER
GEIGER, A
论文数:
0
引用数:
0
h-index:
0
机构:
BELL TEL LABS INC,MURRAY HILL,NJ 07974
GEIGER, A
STILLINGER, FH
论文数:
0
引用数:
0
h-index:
0
机构:
BELL TEL LABS INC,MURRAY HILL,NJ 07974
STILLINGER, FH
RAHMAN, A
论文数:
0
引用数:
0
h-index:
0
机构:
BELL TEL LABS INC,MURRAY HILL,NJ 07974
RAHMAN, A
[J].
JOURNAL OF CHEMICAL PHYSICS,
1979,
70
(09)
: 4185
-
4193
[9]
PAIR INTERACTIONS AND HYDROGEN-BOND NETWORKS IN MODELS OF LIQUID METHANOL
HAUGHNEY, M
论文数:
0
引用数:
0
h-index:
0
机构:
CNR,IST FIS ATOM & MOLEC,I-56100 PISA,ITALY
CNR,IST FIS ATOM & MOLEC,I-56100 PISA,ITALY
HAUGHNEY, M
FERRARIO, M
论文数:
0
引用数:
0
h-index:
0
机构:
CNR,IST FIS ATOM & MOLEC,I-56100 PISA,ITALY
CNR,IST FIS ATOM & MOLEC,I-56100 PISA,ITALY
FERRARIO, M
MCDONALD, IR
论文数:
0
引用数:
0
h-index:
0
机构:
CNR,IST FIS ATOM & MOLEC,I-56100 PISA,ITALY
CNR,IST FIS ATOM & MOLEC,I-56100 PISA,ITALY
MCDONALD, IR
[J].
MOLECULAR PHYSICS,
1986,
58
(04)
: 849
-
853
[10]
MOLECULAR-DYNAMICS SIMULATION OF AN AQUEOUS NACLO4 SOLUTION
HEINJE, G
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MARBURG,PHYS CHEM,HANS MEERWEIN STR,D-3550 MARBURG,FED REP GER
HEINJE, G
LUCK, WAP
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MARBURG,PHYS CHEM,HANS MEERWEIN STR,D-3550 MARBURG,FED REP GER
LUCK, WAP
HEINZINGER, K
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV MARBURG,PHYS CHEM,HANS MEERWEIN STR,D-3550 MARBURG,FED REP GER
HEINZINGER, K
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1987,
91
(02)
: 331
-
338
←
1
2
3
4
→