LONG-RANGE BEHAVIOR OF NATURAL ORBITALS AND ELECTRON-DENSITY - REPLY

被引：47

作者：

LEVY, M ^{[1
]}

PARR, RG ^{[1
]}

机构：

[1] UNIV N CAROLINA,DEPT CHEM,CHAPEL HILL,NC 27514

来源：

JOURNAL OF CHEMICAL PHYSICS | 1976年 / 64卷 / 06期

关键词：

D O I：

10.1063/1.432492

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：2707 / 2708

页数：2

相关论文

共 11 条

[1] ASYMPTOTIC-BEHAVIOR OF ATOMIC BOUND-STATE WAVE-FUNCTIONS
AHLRICHS, R
[J]. JOURNAL OF MATHEMATICAL PHYSICS, 1973, 14 (12) : 1860 - 1863
[2] AHLRICHS R, 1972, CHEM PHYS LETT, V15, P609, DOI 10.1016/0009-2614(72)80386-5
[3] LONG-RANGE BEHAVIOR OF NATURAL ORBITALS AND ELECTRON-DENSITY
AHLRICHS, R
[J]. JOURNAL OF CHEMICAL PHYSICS, 1976, 64 (06) : 2706 - 2707
[4] AHLRICHS R, 1973, CHEM PHYS LETT, V18, P512
[5] Day O. W., 1974, REDUCED DENSITY OPER, P177
[6] EXTENSION OF KOOPMANS THEOREM .2. ACCURATE IONIZATION ENERGIES FROM CORRELATED WAVEFUNCTIONS FOR CLOSED-SHELL ATOMS
DAY, OW
SMITH, DW
MORRISON, RC
[J]. JOURNAL OF CHEMICAL PHYSICS, 1975, 62 (01) : 115 - 119
[7] DAY OW, 1974, INT J QUANTUM CHEM S, V8, P501
[8] QUANTUM THEORY OF MANY-PARTICLE SYSTEMS .1. PHYSICAL INTERPRETATIONS BY MEANS OF DENSITY MATRICES, NATURAL SPIN-ORBITALS, AND CONVERGENCE PROBLEMS IN THE METHOD OF CONFIGURATIONAL INTERACTION
LOWDIN, PO
[J]. PHYSICAL REVIEW, 1955, 97 (06): : 1474 - 1489
[9] CALCULATION OF IONIZATION-POTENTIALS FROM DENSITY MATRICES AND NATURAL FUNCTIONS, AND LONG-RANGE BEHAVIOR OF NATURAL ORBITALS AND ELECTRON-DENSITY
MORRELL, MM
PARR, RG
LEVY, M
[J]. JOURNAL OF CHEMICAL PHYSICS, 1975, 62 (02) : 549 - 554
[10] MORRELL MM, 1974, REDUCED DENSITY MATR, P188