学术探索
学术期刊
新闻热点
数据分析
智能评审
立即登录
AB-INITIO CALCULATION OF VIBRATIONAL FORCE-FIELD OF WATER DIMER
被引:162
作者
:
CURTISS, LA
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
CURTISS, LA
[
1
]
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
机构:
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
POPLE, JA
[
1
]
机构
:
[1]
CARNEGIE MELLON UNIV, DEPT CHEM, PITTSBURGH, PA 15213 USA
来源
:
JOURNAL OF MOLECULAR SPECTROSCOPY
|
1975年
/ 55卷
/ 1-3期
关键词
:
D O I
:
10.1016/0022-2852(75)90245-3
中图分类号
:
O64 [物理化学(理论化学)、化学物理学];
O56 [分子物理学、原子物理学];
学科分类号
:
070203 ;
070304 ;
081704 ;
1406 ;
摘要
:
引用
收藏
页码:1 / 14
页数:14
相关论文
共 26 条
[11]
WATER MOLECULE INTERACTIONS
HANKINS, D
论文数:
0
引用数:
0
h-index:
0
HANKINS, D
MOSKOWITZ, JW
论文数:
0
引用数:
0
h-index:
0
MOSKOWITZ, JW
STILLINGER, FH
论文数:
0
引用数:
0
h-index:
0
STILLINGER, FH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(12)
: 4544
-
+
[12]
EFFECT OF D-FUNCTIONS ON MOLECULAR-ORBITAL ENERGIES FOR HYDROCARBONS
HARIHARAN, PC
论文数:
0
引用数:
0
h-index:
0
HARIHARAN, PC
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
CHEMICAL PHYSICS LETTERS,
1972,
16
(02)
: 217
-
+
[13]
HARIHARAN PVP, UNPUBLISHED RESULTS
[14]
THEORY OF HYDROGEN BOND - ELECTRONIC STRUCTURE AND PROPERTIES OF WATER DIMER
KOLLMAN, PA
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Princeton University, Princeton
KOLLMAN, PA
ALLEN, LC
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Princeton University, Princeton
ALLEN, LC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1969,
51
(08)
: 3286
-
&
[15]
MOLECULAR ORBITAL THEORY OF ELECTRONIC STRUCTURE OF ORGANIC COMPOUNDS .10. SYSTEMATIC STUDY OF GEOMETRIES AND ENERGIES OF AHN MOLECULES AND CATIONS
LATHAN, WA
论文数:
0
引用数:
0
h-index:
0
LATHAN, WA
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
HEHRE, WJ
CURTISS, LA
论文数:
0
引用数:
0
h-index:
0
CURTISS, LA
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1971,
93
(24)
: 6377
-
+
[16]
LATHAN WA, 1974, PROGR PHYS ORG CHEM, V11, P175
[17]
INFRARED ABSORBANCE BY WATER DIMER IN CARBON TETRACHLORIDE SOLUTION
MAGNUSSON, LB
论文数:
0
引用数:
0
h-index:
0
MAGNUSSON, LB
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1970,
74
(24)
: 4221
-
+
[18]
More O'Ferrall R. A., 1971, Journal of the American Chemical Society, V93, P1, DOI 10.1021/ja00730a001
[19]
MOLECULAR ORBITAL STUDIES OF HYDROGEN BONDS - DIMERIC H20 WITH SLATER MINIMAL BASIS SET
MOROKUMA, K
论文数:
0
引用数:
0
h-index:
0
MOROKUMA, K
WINICK, JR
论文数:
0
引用数:
0
h-index:
0
WINICK, JR
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(03)
: 1301
-
&
[20]
MOLECULAR-ORBITAL STUDIES OF HYDROGEN BONDS . AN AB INITIO CALCULATION FOR DIMERIC H2O
MOROKUMA, K
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Harvard University, Cambridge, MA
MOROKUMA, K
PEDERSEN, L
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Harvard University, Cambridge, MA
PEDERSEN, L
[J].
JOURNAL OF CHEMICAL PHYSICS,
1968,
48
(07)
: 3275
-
+
←
1
2
3
→
共 26 条
[11]
WATER MOLECULE INTERACTIONS
HANKINS, D
论文数:
0
引用数:
0
h-index:
0
HANKINS, D
MOSKOWITZ, JW
论文数:
0
引用数:
0
h-index:
0
MOSKOWITZ, JW
STILLINGER, FH
论文数:
0
引用数:
0
h-index:
0
STILLINGER, FH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(12)
: 4544
-
+
[12]
EFFECT OF D-FUNCTIONS ON MOLECULAR-ORBITAL ENERGIES FOR HYDROCARBONS
HARIHARAN, PC
论文数:
0
引用数:
0
h-index:
0
HARIHARAN, PC
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
CHEMICAL PHYSICS LETTERS,
1972,
16
(02)
: 217
-
+
[13]
HARIHARAN PVP, UNPUBLISHED RESULTS
[14]
THEORY OF HYDROGEN BOND - ELECTRONIC STRUCTURE AND PROPERTIES OF WATER DIMER
KOLLMAN, PA
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Princeton University, Princeton
KOLLMAN, PA
ALLEN, LC
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Princeton University, Princeton
ALLEN, LC
[J].
JOURNAL OF CHEMICAL PHYSICS,
1969,
51
(08)
: 3286
-
&
[15]
MOLECULAR ORBITAL THEORY OF ELECTRONIC STRUCTURE OF ORGANIC COMPOUNDS .10. SYSTEMATIC STUDY OF GEOMETRIES AND ENERGIES OF AHN MOLECULES AND CATIONS
LATHAN, WA
论文数:
0
引用数:
0
h-index:
0
LATHAN, WA
HEHRE, WJ
论文数:
0
引用数:
0
h-index:
0
HEHRE, WJ
CURTISS, LA
论文数:
0
引用数:
0
h-index:
0
CURTISS, LA
POPLE, JA
论文数:
0
引用数:
0
h-index:
0
POPLE, JA
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1971,
93
(24)
: 6377
-
+
[16]
LATHAN WA, 1974, PROGR PHYS ORG CHEM, V11, P175
[17]
INFRARED ABSORBANCE BY WATER DIMER IN CARBON TETRACHLORIDE SOLUTION
MAGNUSSON, LB
论文数:
0
引用数:
0
h-index:
0
MAGNUSSON, LB
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1970,
74
(24)
: 4221
-
+
[18]
More O'Ferrall R. A., 1971, Journal of the American Chemical Society, V93, P1, DOI 10.1021/ja00730a001
[19]
MOLECULAR ORBITAL STUDIES OF HYDROGEN BONDS - DIMERIC H20 WITH SLATER MINIMAL BASIS SET
MOROKUMA, K
论文数:
0
引用数:
0
h-index:
0
MOROKUMA, K
WINICK, JR
论文数:
0
引用数:
0
h-index:
0
WINICK, JR
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
52
(03)
: 1301
-
&
[20]
MOLECULAR-ORBITAL STUDIES OF HYDROGEN BONDS . AN AB INITIO CALCULATION FOR DIMERIC H2O
MOROKUMA, K
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Harvard University, Cambridge, MA
MOROKUMA, K
PEDERSEN, L
论文数:
0
引用数:
0
h-index:
0
机构:
Department of Chemistry, Harvard University, Cambridge, MA
PEDERSEN, L
[J].
JOURNAL OF CHEMICAL PHYSICS,
1968,
48
(07)
: 3275
-
+
←
1
2
3
→