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BERKELEY-SYSTEM .3. GENERAL CONFIGURATION-INTERACTION METHODS FOR OPEN-SHELL MOLECULAR ELECTRONIC STATES
被引:15
作者
:
BROOKS, BR
论文数:
0
引用数:
0
h-index:
0
BROOKS, BR
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
SCHAEFER, HF
机构
:
来源
:
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
|
1978年
/ 14卷
/ 05期
关键词
:
D O I
:
10.1002/qua.560140507
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:603 / 612
页数:10
相关论文
共 38 条
[1]
CORRELATION ENERGY AND MOLECULAR PROPERTIES OF HYDROGEN FLUORIDE
BENDER, CF
论文数:
0
引用数:
0
h-index:
0
BENDER, CF
DAVIDSON, ER
论文数:
0
引用数:
0
h-index:
0
DAVIDSON, ER
[J].
JOURNAL OF CHEMICAL PHYSICS,
1967,
47
(02)
: 360
-
&
[2]
N(1AG), T(3B1U), AND V(1B1U) STATES OF VERTICAL ETHYLENE
BROOKS, BR
论文数:
0
引用数:
0
h-index:
0
BROOKS, BR
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
SCHAEFER, HF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1978,
68
(11)
: 4839
-
4847
[3]
MODEL TRANSITION METAL-CARBENE SYSTEM MNCH2
BROOKS, BR
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,LAWRENCE BERKELEY LAB,DEPT CHEM,BERKELEY,CA 94720
BROOKS, BR
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,LAWRENCE BERKELEY LAB,DEPT CHEM,BERKELEY,CA 94720
SCHAEFER, HF
[J].
MOLECULAR PHYSICS,
1977,
34
(01)
: 193
-
213
[4]
ALL-VALENCE-ELECTRON CONFIGURATION MIXING CALCULATIONS FOR CHARACTERIZATION OF 1(PI,PI-STAR) STATES OF ETHYLENE
BUENKER, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,LEHRSTUL THEORET CHEM,53 BONN,FED REP GER
UNIV BONN,LEHRSTUL THEORET CHEM,53 BONN,FED REP GER
BUENKER, RJ
PEYERIMHOFF, SD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,LEHRSTUL THEORET CHEM,53 BONN,FED REP GER
UNIV BONN,LEHRSTUL THEORET CHEM,53 BONN,FED REP GER
PEYERIMHOFF, SD
[J].
CHEMICAL PHYSICS,
1975,
9
(1-2)
: 75
-
89
[5]
ELECTRONIC WAVEFUNCTIONS FOR ATOMS .3. PARTITION OF DEGENERATE SPACES AND GROUND STATE OF C
BUNGE, A
论文数:
0
引用数:
0
h-index:
0
BUNGE, A
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(01)
: 20
-
&
[6]
ELECTRONIC WAVE FUNCTIONS FOR ATOMS .I. GROUND STATE OF BE
BUNGE, CF
论文数:
0
引用数:
0
h-index:
0
BUNGE, CF
[J].
PHYSICAL REVIEW,
1968,
168
(01):
: 92
-
&
[7]
OPTIMIZED VALENCE CONFIGURATIONS AND F2 MOLECULE
DAS, G
论文数:
0
引用数:
0
h-index:
0
DAS, G
WAHL, AC
论文数:
0
引用数:
0
h-index:
0
WAHL, AC
[J].
PHYSICAL REVIEW LETTERS,
1970,
24
(09)
: 440
-
&
[8]
ITERATIVE CALCULATION OF A FEW OF LOWEST EIGENVALUES AND CORRESPONDING EIGENVECTORS OF LARGE REAL-SYMMETRIC MATRICES
DAVIDSON, ER
论文数:
0
引用数:
0
h-index:
0
机构:
BATTELLE MEM INST,505 KING AVE,COLUMBUS,OH 43220
BATTELLE MEM INST,505 KING AVE,COLUMBUS,OH 43220
DAVIDSON, ER
[J].
JOURNAL OF COMPUTATIONAL PHYSICS,
1975,
17
(01)
: 87
-
94
[9]
GENERALIZED VALENCE BOND CALCULATIONS ON GROUND-STATE (X1-SIGMA+(G) OF NITROGEN
DUNNING, TH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,DIV THEORET T-6,LOS ALAMOS,NM 87544
DUNNING, TH
CARTWRIGHT, DC
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,DIV THEORET T-6,LOS ALAMOS,NM 87544
CARTWRIGHT, DC
HUNT, WJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,DIV THEORET T-6,LOS ALAMOS,NM 87544
HUNT, WJ
HAY, PJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,DIV THEORET T-6,LOS ALAMOS,NM 87544
HAY, PJ
BOBROWICZ, FW
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,DIV THEORET T-6,LOS ALAMOS,NM 87544
BOBROWICZ, FW
[J].
JOURNAL OF CHEMICAL PHYSICS,
1976,
64
(11)
: 4755
-
4766
[10]
THEORY OF SELF-CONSISTENT ELECTRON PAIRS - COMPUTATIONAL METHODS AND PRELIMINARY APPLICATIONS
DYKSTRA, CE
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
DYKSTRA, CE
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
SCHAEFER, HF
MEYER, W
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
MEYER, W
[J].
JOURNAL OF CHEMICAL PHYSICS,
1976,
65
(07)
: 2740
-
2750
←
1
2
3
4
→
共 38 条
[1]
CORRELATION ENERGY AND MOLECULAR PROPERTIES OF HYDROGEN FLUORIDE
BENDER, CF
论文数:
0
引用数:
0
h-index:
0
BENDER, CF
DAVIDSON, ER
论文数:
0
引用数:
0
h-index:
0
DAVIDSON, ER
[J].
JOURNAL OF CHEMICAL PHYSICS,
1967,
47
(02)
: 360
-
&
[2]
N(1AG), T(3B1U), AND V(1B1U) STATES OF VERTICAL ETHYLENE
BROOKS, BR
论文数:
0
引用数:
0
h-index:
0
BROOKS, BR
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
SCHAEFER, HF
[J].
JOURNAL OF CHEMICAL PHYSICS,
1978,
68
(11)
: 4839
-
4847
[3]
MODEL TRANSITION METAL-CARBENE SYSTEM MNCH2
BROOKS, BR
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,LAWRENCE BERKELEY LAB,DEPT CHEM,BERKELEY,CA 94720
BROOKS, BR
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,LAWRENCE BERKELEY LAB,DEPT CHEM,BERKELEY,CA 94720
SCHAEFER, HF
[J].
MOLECULAR PHYSICS,
1977,
34
(01)
: 193
-
213
[4]
ALL-VALENCE-ELECTRON CONFIGURATION MIXING CALCULATIONS FOR CHARACTERIZATION OF 1(PI,PI-STAR) STATES OF ETHYLENE
BUENKER, RJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,LEHRSTUL THEORET CHEM,53 BONN,FED REP GER
UNIV BONN,LEHRSTUL THEORET CHEM,53 BONN,FED REP GER
BUENKER, RJ
PEYERIMHOFF, SD
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV BONN,LEHRSTUL THEORET CHEM,53 BONN,FED REP GER
UNIV BONN,LEHRSTUL THEORET CHEM,53 BONN,FED REP GER
PEYERIMHOFF, SD
[J].
CHEMICAL PHYSICS,
1975,
9
(1-2)
: 75
-
89
[5]
ELECTRONIC WAVEFUNCTIONS FOR ATOMS .3. PARTITION OF DEGENERATE SPACES AND GROUND STATE OF C
BUNGE, A
论文数:
0
引用数:
0
h-index:
0
BUNGE, A
[J].
JOURNAL OF CHEMICAL PHYSICS,
1970,
53
(01)
: 20
-
&
[6]
ELECTRONIC WAVE FUNCTIONS FOR ATOMS .I. GROUND STATE OF BE
BUNGE, CF
论文数:
0
引用数:
0
h-index:
0
BUNGE, CF
[J].
PHYSICAL REVIEW,
1968,
168
(01):
: 92
-
&
[7]
OPTIMIZED VALENCE CONFIGURATIONS AND F2 MOLECULE
DAS, G
论文数:
0
引用数:
0
h-index:
0
DAS, G
WAHL, AC
论文数:
0
引用数:
0
h-index:
0
WAHL, AC
[J].
PHYSICAL REVIEW LETTERS,
1970,
24
(09)
: 440
-
&
[8]
ITERATIVE CALCULATION OF A FEW OF LOWEST EIGENVALUES AND CORRESPONDING EIGENVECTORS OF LARGE REAL-SYMMETRIC MATRICES
DAVIDSON, ER
论文数:
0
引用数:
0
h-index:
0
机构:
BATTELLE MEM INST,505 KING AVE,COLUMBUS,OH 43220
BATTELLE MEM INST,505 KING AVE,COLUMBUS,OH 43220
DAVIDSON, ER
[J].
JOURNAL OF COMPUTATIONAL PHYSICS,
1975,
17
(01)
: 87
-
94
[9]
GENERALIZED VALENCE BOND CALCULATIONS ON GROUND-STATE (X1-SIGMA+(G) OF NITROGEN
DUNNING, TH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,DIV THEORET T-6,LOS ALAMOS,NM 87544
DUNNING, TH
CARTWRIGHT, DC
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,DIV THEORET T-6,LOS ALAMOS,NM 87544
CARTWRIGHT, DC
HUNT, WJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,DIV THEORET T-6,LOS ALAMOS,NM 87544
HUNT, WJ
HAY, PJ
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,DIV THEORET T-6,LOS ALAMOS,NM 87544
HAY, PJ
BOBROWICZ, FW
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF LOS ALAMOS SCI LAB,DIV THEORET T-6,LOS ALAMOS,NM 87544
BOBROWICZ, FW
[J].
JOURNAL OF CHEMICAL PHYSICS,
1976,
64
(11)
: 4755
-
4766
[10]
THEORY OF SELF-CONSISTENT ELECTRON PAIRS - COMPUTATIONAL METHODS AND PRELIMINARY APPLICATIONS
DYKSTRA, CE
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
DYKSTRA, CE
SCHAEFER, HF
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
SCHAEFER, HF
MEYER, W
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY,LAWRENCE BERKELEY LAB,DIV MAT & MOLEC RES,BERKELEY,CA 94720
MEYER, W
[J].
JOURNAL OF CHEMICAL PHYSICS,
1976,
65
(07)
: 2740
-
2750
←
1
2
3
4
→