学术探索
学术期刊
新闻热点
数据分析
智能评审
立即登录
CALCULATED PROTON AFFINITIES FOR SOME MOLECULES CONTAINING GROUP VIA ATOMS
被引:25
作者
:
JASIEN, PG
论文数:
0
引用数:
0
h-index:
0
JASIEN, PG
STEVENS, WJ
论文数:
0
引用数:
0
h-index:
0
STEVENS, WJ
机构
:
来源
:
JOURNAL OF CHEMICAL PHYSICS
|
1985年
/ 83卷
/ 06期
关键词
:
D O I
:
10.1063/1.449201
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:2984 / 2989
页数:6
相关论文
共 41 条
[11]
THE ROTATIONAL SPECTRA OF HOCO+, HOCN, HN3, AND HNCO FROM QUANTUM-MECHANICAL CALCULATIONS
DEFREES, DJ
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
DEFREES, DJ
LOEW, GH
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
LOEW, GH
MCLEAN, AD
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
MCLEAN, AD
[J].
ASTROPHYSICAL JOURNAL,
1982,
254
(01)
: 405
-
411
[12]
MOLECULAR-ORBITAL STUDY OF SOME PROTONATED BASES
DELBENE, JE
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
DELBENE, JE
FRISCH, MJ
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
FRISCH, MJ
RAGHAVACHARI, K
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
RAGHAVACHARI, K
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
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1982,
86
(09)
: 1529
-
1535
[13]
GEOMETRY, BASIS SET, AN CORRELATION-ENERGY DEPENDENCE OF COMPUTED PROTONATION ENERGIES OF CARBONYL BASES
DELBENE, JE
论文数:
0
引用数:
0
h-index:
0
DELBENE, JE
[J].
CHEMICAL PHYSICS LETTERS,
1983,
94
(02)
: 213
-
217
[14]
COLLISIONAL ACTIVATION AND METASTABLE ION CHARACTERISTICS .65. COLLISIONAL ACTIVATION AND THEORETICAL STUDIES OF GASEOUS CSH3+ IONS
DILL, JD
论文数:
0
引用数:
0
h-index:
0
机构:
CORNELL UNIV,DEPT CHEM,SPENCER T OLIN LAB,ITHACA,NY 14853
CORNELL UNIV,DEPT CHEM,SPENCER T OLIN LAB,ITHACA,NY 14853
DILL, JD
MCLAFFERTY, FW
论文数:
0
引用数:
0
h-index:
0
机构:
CORNELL UNIV,DEPT CHEM,SPENCER T OLIN LAB,ITHACA,NY 14853
CORNELL UNIV,DEPT CHEM,SPENCER T OLIN LAB,ITHACA,NY 14853
MCLAFFERTY, FW
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1979,
101
(22)
: 6526
-
6531
[15]
ENERGETICS OF THE PROTONATION OF CO - IMPLICATIONS FOR THE OBSERVATION OF HOC+ IN DENSE INTERSTELLAR CLOUDS
DIXON, DA
论文数:
0
引用数:
0
h-index:
0
机构:
MAX PLANCK INST PHYS & ASTROPHYS, INST ASTROPHYS, D-8046 GARCHING, FED REP GER
DIXON, DA
KOMORNICKI, A
论文数:
0
引用数:
0
h-index:
0
机构:
MAX PLANCK INST PHYS & ASTROPHYS, INST ASTROPHYS, D-8046 GARCHING, FED REP GER
KOMORNICKI, A
KRAEMER, WP
论文数:
0
引用数:
0
h-index:
0
机构:
MAX PLANCK INST PHYS & ASTROPHYS, INST ASTROPHYS, D-8046 GARCHING, FED REP GER
KRAEMER, WP
[J].
JOURNAL OF CHEMICAL PHYSICS,
1984,
81
(08)
: 3603
-
3611
[16]
DIXON DA, UNPUB MOL STRUCTURE
[17]
GAUSSIAN BASIS FUNCTIONS FOR USE IN MOLECULAR CALCULATIONS .1. CONTRACTION OF (9S5P) ATOMIC BASIS SETS FOR FIRST-ROW ATOMS
DUNNING, TH
论文数:
0
引用数:
0
h-index:
0
DUNNING, TH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(07)
: 2823
-
+
[18]
MOLECULAR SYMMETRY AND CLOSED-SHELL SCF CALCULATIONS .1.
DUPUIS, M
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
DUPUIS, M
KING, HF
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
KING, HF
[J].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1977,
11
(04)
: 613
-
625
[19]
MOLECULAR SYMMETRY .2. GRADIENT OF ELECTRONIC-ENERGY WITH RESPECT TO NUCLEAR COORDINATES
DUPUIS, M
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
DUPUIS, M
KING, HF
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
KING, HF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1978,
68
(09)
: 3998
-
4004
[20]
RECENT COMPUTATIONAL DEVELOPMENTS WITH THE SELF-CONSISTENT ELECTRON PAIRS METHOD AND APPLICATION TO THE STABILITY OF GLYCINE CONFORMERS
DYKSTRA, CE
论文数:
0
引用数:
0
h-index:
0
DYKSTRA, CE
CHILES, RA
论文数:
0
引用数:
0
h-index:
0
CHILES, RA
GARRETT, MD
论文数:
0
引用数:
0
h-index:
0
GARRETT, MD
[J].
JOURNAL OF COMPUTATIONAL CHEMISTRY,
1981,
2
(03)
: 266
-
272
←
1
2
3
4
5
→
共 41 条
[11]
THE ROTATIONAL SPECTRA OF HOCO+, HOCN, HN3, AND HNCO FROM QUANTUM-MECHANICAL CALCULATIONS
DEFREES, DJ
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
DEFREES, DJ
LOEW, GH
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
LOEW, GH
MCLEAN, AD
论文数:
0
引用数:
0
h-index:
0
机构:
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
IBM CORP, RES LAB, SAN JOSE, CA 95193 USA
MCLEAN, AD
[J].
ASTROPHYSICAL JOURNAL,
1982,
254
(01)
: 405
-
411
[12]
MOLECULAR-ORBITAL STUDY OF SOME PROTONATED BASES
DELBENE, JE
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
DELBENE, JE
FRISCH, MJ
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
FRISCH, MJ
RAGHAVACHARI, K
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
RAGHAVACHARI, K
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
[J].
JOURNAL OF PHYSICAL CHEMISTRY,
1982,
86
(09)
: 1529
-
1535
[13]
GEOMETRY, BASIS SET, AN CORRELATION-ENERGY DEPENDENCE OF COMPUTED PROTONATION ENERGIES OF CARBONYL BASES
DELBENE, JE
论文数:
0
引用数:
0
h-index:
0
DELBENE, JE
[J].
CHEMICAL PHYSICS LETTERS,
1983,
94
(02)
: 213
-
217
[14]
COLLISIONAL ACTIVATION AND METASTABLE ION CHARACTERISTICS .65. COLLISIONAL ACTIVATION AND THEORETICAL STUDIES OF GASEOUS CSH3+ IONS
DILL, JD
论文数:
0
引用数:
0
h-index:
0
机构:
CORNELL UNIV,DEPT CHEM,SPENCER T OLIN LAB,ITHACA,NY 14853
CORNELL UNIV,DEPT CHEM,SPENCER T OLIN LAB,ITHACA,NY 14853
DILL, JD
MCLAFFERTY, FW
论文数:
0
引用数:
0
h-index:
0
机构:
CORNELL UNIV,DEPT CHEM,SPENCER T OLIN LAB,ITHACA,NY 14853
CORNELL UNIV,DEPT CHEM,SPENCER T OLIN LAB,ITHACA,NY 14853
MCLAFFERTY, FW
[J].
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY,
1979,
101
(22)
: 6526
-
6531
[15]
ENERGETICS OF THE PROTONATION OF CO - IMPLICATIONS FOR THE OBSERVATION OF HOC+ IN DENSE INTERSTELLAR CLOUDS
DIXON, DA
论文数:
0
引用数:
0
h-index:
0
机构:
MAX PLANCK INST PHYS & ASTROPHYS, INST ASTROPHYS, D-8046 GARCHING, FED REP GER
DIXON, DA
KOMORNICKI, A
论文数:
0
引用数:
0
h-index:
0
机构:
MAX PLANCK INST PHYS & ASTROPHYS, INST ASTROPHYS, D-8046 GARCHING, FED REP GER
KOMORNICKI, A
KRAEMER, WP
论文数:
0
引用数:
0
h-index:
0
机构:
MAX PLANCK INST PHYS & ASTROPHYS, INST ASTROPHYS, D-8046 GARCHING, FED REP GER
KRAEMER, WP
[J].
JOURNAL OF CHEMICAL PHYSICS,
1984,
81
(08)
: 3603
-
3611
[16]
DIXON DA, UNPUB MOL STRUCTURE
[17]
GAUSSIAN BASIS FUNCTIONS FOR USE IN MOLECULAR CALCULATIONS .1. CONTRACTION OF (9S5P) ATOMIC BASIS SETS FOR FIRST-ROW ATOMS
DUNNING, TH
论文数:
0
引用数:
0
h-index:
0
DUNNING, TH
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(07)
: 2823
-
+
[18]
MOLECULAR SYMMETRY AND CLOSED-SHELL SCF CALCULATIONS .1.
DUPUIS, M
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
DUPUIS, M
KING, HF
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
KING, HF
[J].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1977,
11
(04)
: 613
-
625
[19]
MOLECULAR SYMMETRY .2. GRADIENT OF ELECTRONIC-ENERGY WITH RESPECT TO NUCLEAR COORDINATES
DUPUIS, M
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
DUPUIS, M
KING, HF
论文数:
0
引用数:
0
h-index:
0
机构:
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
SUNY BUFFALO,DEPT CHEM,BUFFALO,NY 14214
KING, HF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1978,
68
(09)
: 3998
-
4004
[20]
RECENT COMPUTATIONAL DEVELOPMENTS WITH THE SELF-CONSISTENT ELECTRON PAIRS METHOD AND APPLICATION TO THE STABILITY OF GLYCINE CONFORMERS
DYKSTRA, CE
论文数:
0
引用数:
0
h-index:
0
DYKSTRA, CE
CHILES, RA
论文数:
0
引用数:
0
h-index:
0
CHILES, RA
GARRETT, MD
论文数:
0
引用数:
0
h-index:
0
GARRETT, MD
[J].
JOURNAL OF COMPUTATIONAL CHEMISTRY,
1981,
2
(03)
: 266
-
272
←
1
2
3
4
5
→