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MULTICONFIGURATION TIME-DEPENDENT SELF-CONSISTENT FIELD APPROXIMATION FOR CURVE CROSSING IN PRESENCE OF A BATH - A FAST FOURIER-TRANSFORM STUDY
被引:94
作者
:
KOTLER, Z
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,DEPT PHYS CHEM,IL-91904 JERUSALEM,ISRAEL
KOTLER, Z
NITZAN, A
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,DEPT PHYS CHEM,IL-91904 JERUSALEM,ISRAEL
NITZAN, A
KOSLOFF, R
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,DEPT PHYS CHEM,IL-91904 JERUSALEM,ISRAEL
KOSLOFF, R
机构
:
[1]
HEBREW UNIV JERUSALEM,DEPT PHYS CHEM,IL-91904 JERUSALEM,ISRAEL
[2]
HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
来源
:
CHEMICAL PHYSICS LETTERS
|
1988年
/ 153卷
/ 06期
关键词
:
D O I
:
10.1016/0009-2614(88)85247-3
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:483 / 489
页数:7
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EXACT TIME-DEPENDENT QUANTUM-MECHANICAL DISSOCIATION DYNAMICS OF I2HE - COMPARISON OF EXACT TIME-DEPENDENT QUANTUM CALCULATION WITH THE QUANTUM TIME-DEPENDENT SELF-CONSISTENT (TDSCF) APPROXIMATION
[J].
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HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
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;
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引用数:
0
h-index:
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HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
KOSLOFF, R
;
GERBER, RB
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HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
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HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
RATNER, MA
;
GIBSON, L
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HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
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JOURNAL OF CHEMICAL PHYSICS,
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:2760
-2765
[2]
SOLUTION OF THE SCHRODINGER-EQUATION BY A SPECTRAL METHOD
[J].
FEIT, MD
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RATE THEORIES AND PUZZLES OF HEMEPROTEIN KINETICS
[J].
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0
引用数:
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UNIV ILLINOIS, CHEM, URBANA, IL 61801 USA
UNIV ILLINOIS, CHEM, URBANA, IL 61801 USA
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;
WOLYNES, PG
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UNIV ILLINOIS, CHEM, URBANA, IL 61801 USA
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EFFECT OF FRICTION ON ELECTRON-TRANSFER IN BIOMOLECULES
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[J].
GERBER, RB
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RATNER, MA
.
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[7]
A FOURIER METHOD SOLUTION FOR THE TIME-DEPENDENT SCHRODINGER-EQUATION AS A TOOL IN MOLECULAR-DYNAMICS
[J].
KOSLOFF, D
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h-index:
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HEBREW UNIV JERUSALEM,DEPT PHYS CHEM,IL-91904 JERUSALEM,ISRAEL
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[J].
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HEBREW UNIV JERUSALEM,FRITZ HABER CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
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KOSLOFF, R
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KOSLOFF, D
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HEBREW UNIV JERUSALEM,FRITZ HABER CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
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[10]
TIME-DEPENDENT SELF-CONSISTENT FIELD (TDSCF) APPROXIMATION FOR A REACTION COORDINATE COUPLED TO A HARMONIC BATH - SINGLE AND MULTIPLE CONFIGURATION TREATMENTS
[J].
MAKRI, N
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
MAKRI, N
;
MILLER, WH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
MILLER, WH
.
JOURNAL OF CHEMICAL PHYSICS,
1987,
87
(10)
:5781
-5787
←
1
2
→
共 15 条
[1]
EXACT TIME-DEPENDENT QUANTUM-MECHANICAL DISSOCIATION DYNAMICS OF I2HE - COMPARISON OF EXACT TIME-DEPENDENT QUANTUM CALCULATION WITH THE QUANTUM TIME-DEPENDENT SELF-CONSISTENT (TDSCF) APPROXIMATION
[J].
BISSELING, RH
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
BISSELING, RH
;
KOSLOFF, R
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
KOSLOFF, R
;
GERBER, RB
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
GERBER, RB
;
RATNER, MA
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
RATNER, MA
;
GIBSON, L
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
GIBSON, L
;
CERJAN, C
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
CERJAN, C
.
JOURNAL OF CHEMICAL PHYSICS,
1987,
87
(05)
:2760
-2765
[2]
SOLUTION OF THE SCHRODINGER-EQUATION BY A SPECTRAL METHOD
[J].
FEIT, MD
论文数:
0
引用数:
0
h-index:
0
FEIT, MD
;
FLECK, JA
论文数:
0
引用数:
0
h-index:
0
FLECK, JA
;
STEIGER, A
论文数:
0
引用数:
0
h-index:
0
STEIGER, A
.
JOURNAL OF COMPUTATIONAL PHYSICS,
1982,
47
(03)
:412
-433
[3]
RATE THEORIES AND PUZZLES OF HEMEPROTEIN KINETICS
[J].
FRAUENFELDER, H
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ILLINOIS, CHEM, URBANA, IL 61801 USA
UNIV ILLINOIS, CHEM, URBANA, IL 61801 USA
FRAUENFELDER, H
;
WOLYNES, PG
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ILLINOIS, CHEM, URBANA, IL 61801 USA
UNIV ILLINOIS, CHEM, URBANA, IL 61801 USA
WOLYNES, PG
.
SCIENCE,
1985,
229
(4711)
:337
-345
[4]
EFFECT OF FRICTION ON ELECTRON-TRANSFER IN BIOMOLECULES
[J].
GARG, A
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ILLINOIS,DEPT PHYS,URBANA,IL 61801
GARG, A
;
ONUCHIC, JN
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ILLINOIS,DEPT PHYS,URBANA,IL 61801
ONUCHIC, JN
;
AMBEGAOKAR, V
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV ILLINOIS,DEPT PHYS,URBANA,IL 61801
AMBEGAOKAR, V
.
JOURNAL OF CHEMICAL PHYSICS,
1985,
83
(09)
:4491
-4503
[5]
TIME-DEPENDENT SELF-CONSISTENT FIELD APPROXIMATION FOR INTRAMOLECULAR ENERGY-TRANSFER .1. FORMULATION AND APPLICATION TO DISSOCIATION OF VANDERWAALS MOLECULES
[J].
GERBER, RB
论文数:
0
引用数:
0
h-index:
0
机构:
NORTHWESTERN UNIV,DEPT CHEM,EVANSTON,IL 60201
NORTHWESTERN UNIV,DEPT CHEM,EVANSTON,IL 60201
GERBER, RB
;
BUCH, V
论文数:
0
引用数:
0
h-index:
0
机构:
NORTHWESTERN UNIV,DEPT CHEM,EVANSTON,IL 60201
NORTHWESTERN UNIV,DEPT CHEM,EVANSTON,IL 60201
BUCH, V
;
RATNER, MA
论文数:
0
引用数:
0
h-index:
0
机构:
NORTHWESTERN UNIV,DEPT CHEM,EVANSTON,IL 60201
NORTHWESTERN UNIV,DEPT CHEM,EVANSTON,IL 60201
RATNER, MA
.
JOURNAL OF CHEMICAL PHYSICS,
1982,
77
(06)
:3022
-3030
[6]
SELF-CONSISTENT-FIELD METHODS FOR VIBRATIONAL EXCITATIONS IN POLYATOMIC SYSTEMS
[J].
GERBER, RB
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
GERBER, RB
;
RATNER, MA
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,FRITZ HABER RES CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
RATNER, MA
.
ADVANCES IN CHEMICAL PHYSICS,
1988,
70
:97
-132
[7]
A FOURIER METHOD SOLUTION FOR THE TIME-DEPENDENT SCHRODINGER-EQUATION AS A TOOL IN MOLECULAR-DYNAMICS
[J].
KOSLOFF, D
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,DEPT PHYS CHEM,IL-91904 JERUSALEM,ISRAEL
KOSLOFF, D
;
KOSLOFF, R
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,DEPT PHYS CHEM,IL-91904 JERUSALEM,ISRAEL
KOSLOFF, R
.
JOURNAL OF COMPUTATIONAL PHYSICS,
1983,
52
(01)
:35
-53
[8]
A FOURIER METHOD SOLUTION FOR THE TIME-DEPENDENT SCHRODINGER-EQUATION - A STUDY OF THE REACTION H++H-2, D++HD, AND D++H-2
[J].
KOSLOFF, R
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,FRITZ HABER CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
HEBREW UNIV JERUSALEM,FRITZ HABER CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
KOSLOFF, R
;
KOSLOFF, D
论文数:
0
引用数:
0
h-index:
0
机构:
HEBREW UNIV JERUSALEM,FRITZ HABER CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
HEBREW UNIV JERUSALEM,FRITZ HABER CTR MOLEC DYNAM,IL-91904 JERUSALEM,ISRAEL
KOSLOFF, D
.
JOURNAL OF CHEMICAL PHYSICS,
1983,
79
(04)
:1823
-1833
[9]
KOSLOFF R, 1987, LARGE FINITE SYSTEMS
[10]
TIME-DEPENDENT SELF-CONSISTENT FIELD (TDSCF) APPROXIMATION FOR A REACTION COORDINATE COUPLED TO A HARMONIC BATH - SINGLE AND MULTIPLE CONFIGURATION TREATMENTS
[J].
MAKRI, N
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
MAKRI, N
;
MILLER, WH
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
UNIV CALIF BERKELEY LAWRENCE BERKELEY LAB,DIV MAT & CHEM SCI,BERKELEY,CA 94720
MILLER, WH
.
JOURNAL OF CHEMICAL PHYSICS,
1987,
87
(10)
:5781
-5787
←
1
2
→