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MUFFIN-TIN ORBITALS AND TOTAL ENERGY OF ATOMIC CLUSTERS
被引:124
作者
:
GUNNARSSON, O
论文数:
0
引用数:
0
h-index:
0
机构:
KFA JULICH GMBH,INST FESTKORPERFORSCH,D-5170 JULICH 1,FED REP GER
KFA JULICH GMBH,INST FESTKORPERFORSCH,D-5170 JULICH 1,FED REP GER
GUNNARSSON, O
[
1
]
HARRIS, J
论文数:
0
引用数:
0
h-index:
0
机构:
KFA JULICH GMBH,INST FESTKORPERFORSCH,D-5170 JULICH 1,FED REP GER
KFA JULICH GMBH,INST FESTKORPERFORSCH,D-5170 JULICH 1,FED REP GER
HARRIS, J
[
1
]
JONES, RO
论文数:
0
引用数:
0
h-index:
0
机构:
KFA JULICH GMBH,INST FESTKORPERFORSCH,D-5170 JULICH 1,FED REP GER
KFA JULICH GMBH,INST FESTKORPERFORSCH,D-5170 JULICH 1,FED REP GER
JONES, RO
[
1
]
机构
:
[1]
KFA JULICH GMBH,INST FESTKORPERFORSCH,D-5170 JULICH 1,FED REP GER
来源
:
PHYSICAL REVIEW B
|
1977年
/ 15卷
/ 06期
关键词
:
D O I
:
10.1103/PhysRevB.15.3027
中图分类号
:
T [工业技术];
学科分类号
:
08 ;
摘要
:
引用
收藏
页码:3027 / 3038
页数:12
相关论文
共 27 条
[1]
ABRAMOWITZ M, 1965, HDB MATH FUNCTIONS, P437
[2]
LINEAR METHODS IN BAND THEORY
ANDERSEN, OK
论文数:
0
引用数:
0
h-index:
0
机构:
TECH UNIV LYNGBY, DEPT ELECTROPHYS, LYNGBY, DENMARK
TECH UNIV LYNGBY, DEPT ELECTROPHYS, LYNGBY, DENMARK
ANDERSEN, OK
[J].
PHYSICAL REVIEW B,
1975,
12
(08):
: 3060
-
3083
[3]
MUFFIN-TIN ORBITALS AND MOLECULAR CALCULATIONS - GENERAL FORMALISM
ANDERSEN, OK
论文数:
0
引用数:
0
h-index:
0
机构:
TECH UNIV LYNGBY, DEPT ELECTROPHYS, 2800 LYNGBY, DENMARK
ANDERSEN, OK
WOOLLEY, RG
论文数:
0
引用数:
0
h-index:
0
机构:
TECH UNIV LYNGBY, DEPT ELECTROPHYS, 2800 LYNGBY, DENMARK
WOOLLEY, RG
[J].
MOLECULAR PHYSICS,
1973,
26
(04)
: 905
-
927
[4]
Self-consistent molecular Hartree-Fock-Slater calculations - II. The effect of exchange scaling in some small molecules
Baerends, E. J.
论文数:
0
引用数:
0
h-index:
0
机构:
Vrije Univ Amsterdam, Scheikundig Lab, Amsterdam, Netherlands
Vrije Univ Amsterdam, Scheikundig Lab, Amsterdam, Netherlands
Baerends, E. J.
Ros, P.
论文数:
0
引用数:
0
h-index:
0
机构:
Vrije Univ Amsterdam, Scheikundig Lab, Amsterdam, Netherlands
Vrije Univ Amsterdam, Scheikundig Lab, Amsterdam, Netherlands
Ros, P.
[J].
CHEMICAL PHYSICS,
1973,
2
(01)
: 52
-
59
[5]
CALCULATION OF TOTAL ENERGY IN MULTIPLE SCATTERING-X ALPHA METHOD .2. NUMERICAL TECHNIQUE AND RESULTS
DANESE, JB
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV FLORIDA,DEPT PHYS,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
UNIV FLORIDA,DEPT PHYS,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
DANESE, JB
[J].
JOURNAL OF CHEMICAL PHYSICS,
1974,
61
(08)
: 3071
-
3080
[6]
EXCHANGE AND CORRELATION IN ATOMS, MOLECULES, AND SOLIDS BY SPIN-DENSITY FUNCTIONAL FORMALISM
GUNNARSSON, O
论文数:
0
引用数:
0
h-index:
0
机构:
AARHUS UNIV, INST PHYS, DK-8000 AARHUS, DENMARK
GUNNARSSON, O
LUNDQVIST, BI
论文数:
0
引用数:
0
h-index:
0
机构:
AARHUS UNIV, INST PHYS, DK-8000 AARHUS, DENMARK
LUNDQVIST, BI
[J].
PHYSICAL REVIEW B,
1976,
13
(10)
: 4274
-
4298
[7]
CLUSTER CALCULATIONS USING MUFFIN-TIN ORBITALS
GUNNARSSON, O
论文数:
0
引用数:
0
h-index:
0
机构:
KFA JULICH GMBH,INST FESTKORPER FORSCH,D-5170 JULICH,FED REP GER
KFA JULICH GMBH,INST FESTKORPER FORSCH,D-5170 JULICH,FED REP GER
GUNNARSSON, O
HARRIS, J
论文数:
0
引用数:
0
h-index:
0
机构:
KFA JULICH GMBH,INST FESTKORPER FORSCH,D-5170 JULICH,FED REP GER
KFA JULICH GMBH,INST FESTKORPER FORSCH,D-5170 JULICH,FED REP GER
HARRIS, J
JONES, RO
论文数:
0
引用数:
0
h-index:
0
机构:
KFA JULICH GMBH,INST FESTKORPER FORSCH,D-5170 JULICH,FED REP GER
KFA JULICH GMBH,INST FESTKORPER FORSCH,D-5170 JULICH,FED REP GER
JONES, RO
[J].
JOURNAL OF PHYSICS C-SOLID STATE PHYSICS,
1976,
9
(14):
: 2739
-
2748
[8]
SPIN-DENSITY FUNCTIONAL FORMALISM FOR QUANTUM-MECHANICAL CALCULATIONS - TEST ON DIATOMIC-MOLECULES WITH AN EFFICIENT NUMERICAL-METHOD
GUNNARSSON, O
论文数:
0
引用数:
0
h-index:
0
机构:
CHALMERS UNIV TECHNOL, INST THEORET PHYS, S-40220 GOTHENBURG 5, SWEDEN
CHALMERS UNIV TECHNOL, INST THEORET PHYS, S-40220 GOTHENBURG 5, SWEDEN
GUNNARSSON, O
JOHANSSON, P
论文数:
0
引用数:
0
h-index:
0
机构:
CHALMERS UNIV TECHNOL, INST THEORET PHYS, S-40220 GOTHENBURG 5, SWEDEN
CHALMERS UNIV TECHNOL, INST THEORET PHYS, S-40220 GOTHENBURG 5, SWEDEN
JOHANSSON, P
[J].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1976,
10
(02)
: 307
-
323
[9]
GUNNARSSON O, UNPUBLISHED
[10]
INHOMOGENEOUS ELECTRON-GAS
RAJAGOPAL, AK
论文数:
0
引用数:
0
h-index:
0
机构:
LOUISIANA STATE UNIV, DEPT PHYS & ASTRONOMY, BATON ROUGE, LA 70803 USA
LOUISIANA STATE UNIV, DEPT PHYS & ASTRONOMY, BATON ROUGE, LA 70803 USA
RAJAGOPAL, AK
CALLAWAY, J
论文数:
0
引用数:
0
h-index:
0
机构:
LOUISIANA STATE UNIV, DEPT PHYS & ASTRONOMY, BATON ROUGE, LA 70803 USA
LOUISIANA STATE UNIV, DEPT PHYS & ASTRONOMY, BATON ROUGE, LA 70803 USA
CALLAWAY, J
[J].
PHYSICAL REVIEW B,
1973,
7
(05)
: 1912
-
1919
←
1
2
3
→
共 27 条
[1]
ABRAMOWITZ M, 1965, HDB MATH FUNCTIONS, P437
[2]
LINEAR METHODS IN BAND THEORY
ANDERSEN, OK
论文数:
0
引用数:
0
h-index:
0
机构:
TECH UNIV LYNGBY, DEPT ELECTROPHYS, LYNGBY, DENMARK
TECH UNIV LYNGBY, DEPT ELECTROPHYS, LYNGBY, DENMARK
ANDERSEN, OK
[J].
PHYSICAL REVIEW B,
1975,
12
(08):
: 3060
-
3083
[3]
MUFFIN-TIN ORBITALS AND MOLECULAR CALCULATIONS - GENERAL FORMALISM
ANDERSEN, OK
论文数:
0
引用数:
0
h-index:
0
机构:
TECH UNIV LYNGBY, DEPT ELECTROPHYS, 2800 LYNGBY, DENMARK
ANDERSEN, OK
WOOLLEY, RG
论文数:
0
引用数:
0
h-index:
0
机构:
TECH UNIV LYNGBY, DEPT ELECTROPHYS, 2800 LYNGBY, DENMARK
WOOLLEY, RG
[J].
MOLECULAR PHYSICS,
1973,
26
(04)
: 905
-
927
[4]
Self-consistent molecular Hartree-Fock-Slater calculations - II. The effect of exchange scaling in some small molecules
Baerends, E. J.
论文数:
0
引用数:
0
h-index:
0
机构:
Vrije Univ Amsterdam, Scheikundig Lab, Amsterdam, Netherlands
Vrije Univ Amsterdam, Scheikundig Lab, Amsterdam, Netherlands
Baerends, E. J.
Ros, P.
论文数:
0
引用数:
0
h-index:
0
机构:
Vrije Univ Amsterdam, Scheikundig Lab, Amsterdam, Netherlands
Vrije Univ Amsterdam, Scheikundig Lab, Amsterdam, Netherlands
Ros, P.
[J].
CHEMICAL PHYSICS,
1973,
2
(01)
: 52
-
59
[5]
CALCULATION OF TOTAL ENERGY IN MULTIPLE SCATTERING-X ALPHA METHOD .2. NUMERICAL TECHNIQUE AND RESULTS
DANESE, JB
论文数:
0
引用数:
0
h-index:
0
机构:
UNIV FLORIDA,DEPT PHYS,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
UNIV FLORIDA,DEPT PHYS,QUANTUM THEORY PROJECT,GAINESVILLE,FL 32611
DANESE, JB
[J].
JOURNAL OF CHEMICAL PHYSICS,
1974,
61
(08)
: 3071
-
3080
[6]
EXCHANGE AND CORRELATION IN ATOMS, MOLECULES, AND SOLIDS BY SPIN-DENSITY FUNCTIONAL FORMALISM
GUNNARSSON, O
论文数:
0
引用数:
0
h-index:
0
机构:
AARHUS UNIV, INST PHYS, DK-8000 AARHUS, DENMARK
GUNNARSSON, O
LUNDQVIST, BI
论文数:
0
引用数:
0
h-index:
0
机构:
AARHUS UNIV, INST PHYS, DK-8000 AARHUS, DENMARK
LUNDQVIST, BI
[J].
PHYSICAL REVIEW B,
1976,
13
(10)
: 4274
-
4298
[7]
CLUSTER CALCULATIONS USING MUFFIN-TIN ORBITALS
GUNNARSSON, O
论文数:
0
引用数:
0
h-index:
0
机构:
KFA JULICH GMBH,INST FESTKORPER FORSCH,D-5170 JULICH,FED REP GER
KFA JULICH GMBH,INST FESTKORPER FORSCH,D-5170 JULICH,FED REP GER
GUNNARSSON, O
HARRIS, J
论文数:
0
引用数:
0
h-index:
0
机构:
KFA JULICH GMBH,INST FESTKORPER FORSCH,D-5170 JULICH,FED REP GER
KFA JULICH GMBH,INST FESTKORPER FORSCH,D-5170 JULICH,FED REP GER
HARRIS, J
JONES, RO
论文数:
0
引用数:
0
h-index:
0
机构:
KFA JULICH GMBH,INST FESTKORPER FORSCH,D-5170 JULICH,FED REP GER
KFA JULICH GMBH,INST FESTKORPER FORSCH,D-5170 JULICH,FED REP GER
JONES, RO
[J].
JOURNAL OF PHYSICS C-SOLID STATE PHYSICS,
1976,
9
(14):
: 2739
-
2748
[8]
SPIN-DENSITY FUNCTIONAL FORMALISM FOR QUANTUM-MECHANICAL CALCULATIONS - TEST ON DIATOMIC-MOLECULES WITH AN EFFICIENT NUMERICAL-METHOD
GUNNARSSON, O
论文数:
0
引用数:
0
h-index:
0
机构:
CHALMERS UNIV TECHNOL, INST THEORET PHYS, S-40220 GOTHENBURG 5, SWEDEN
CHALMERS UNIV TECHNOL, INST THEORET PHYS, S-40220 GOTHENBURG 5, SWEDEN
GUNNARSSON, O
JOHANSSON, P
论文数:
0
引用数:
0
h-index:
0
机构:
CHALMERS UNIV TECHNOL, INST THEORET PHYS, S-40220 GOTHENBURG 5, SWEDEN
CHALMERS UNIV TECHNOL, INST THEORET PHYS, S-40220 GOTHENBURG 5, SWEDEN
JOHANSSON, P
[J].
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY,
1976,
10
(02)
: 307
-
323
[9]
GUNNARSSON O, UNPUBLISHED
[10]
INHOMOGENEOUS ELECTRON-GAS
RAJAGOPAL, AK
论文数:
0
引用数:
0
h-index:
0
机构:
LOUISIANA STATE UNIV, DEPT PHYS & ASTRONOMY, BATON ROUGE, LA 70803 USA
LOUISIANA STATE UNIV, DEPT PHYS & ASTRONOMY, BATON ROUGE, LA 70803 USA
RAJAGOPAL, AK
CALLAWAY, J
论文数:
0
引用数:
0
h-index:
0
机构:
LOUISIANA STATE UNIV, DEPT PHYS & ASTRONOMY, BATON ROUGE, LA 70803 USA
LOUISIANA STATE UNIV, DEPT PHYS & ASTRONOMY, BATON ROUGE, LA 70803 USA
CALLAWAY, J
[J].
PHYSICAL REVIEW B,
1973,
7
(05)
: 1912
-
1919
←
1
2
3
→