STRUCTURES AND ELECTRONIC PROPERTIES OF COPPER CLUSTERS AND BULK - COMMENTS ON MULLIKEN-WALSH DIAGRAMS AND ON CRITICISMS OF EXTENDED HUCKEL PROCEDURE

被引:87
作者
ANDERSON, AB
机构
关键词
D O I
10.1063/1.435944
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:1744 / 1751
页数:8
相关论文
共 57 条
[1]   DETERMINATION OF CHALCOGEN STRUCTURES ON NICKEL SURFACES FROM ORBITAL ENERGIES ADDED TO PAIRWISE ATOMIC REPULSIONS [J].
ANDERSON, AB .
JOURNAL OF CHEMICAL PHYSICS, 1977, 66 (05) :2173-2175
[2]   MOLECULAR-ORBITAL THEORY OF BONDING OF NITROGEN-ATOMS TO CU(100) [J].
ANDERSON, AB .
CHEMICAL PHYSICS LETTERS, 1977, 49 (03) :550-554
[3]   VALENCE FORCE-FIELD POTENTIALS FOR DIAMONDLIKE CRYSTALS [J].
ANDERSON, AB .
PHYSICAL REVIEW B, 1973, 8 (08) :3824-3827
[4]   THEORETICAL-STUDY OF STRUCTURES AND BINDING PROPERTIES OF NICKEL TETRACARBONYL, IRON PENTACARBONYL, AND DIIRON AND DICOBALT HEXACARBONYL ACETYLENES [J].
ANDERSON, AB .
INORGANIC CHEMISTRY, 1976, 15 (11) :2598-2602
[5]   VIBRATIONAL POTENTIALS AND STRUCTURES IN MOLECULAR AND SOLID CARBON, SILICON, GERMANIUM, AND TIN [J].
ANDERSON, AB .
JOURNAL OF CHEMICAL PHYSICS, 1975, 63 (10) :4430-4436
[6]   STRUCTURES, BINDING-ENERGIES, AND CHARGE-DISTRIBUTIONS FOR 2 TO 6 ATOM TI, CR, FE, AND NI CLUSTERS AND THEIR RELATIONSHIP TO NUCLEATION AND CLUSTER CATALYSIS [J].
ANDERSON, AB .
JOURNAL OF CHEMICAL PHYSICS, 1976, 64 (10) :4046-4055
[7]   DERIVATION OF EXTENDED HUCKEL METHOD WITH CORRECTIONS - ONE ELECTRON MOLECULAR-ORBITAL THEORY FOR ENERGY-LEVEL AND STRUCTURE DETERMINATIONS [J].
ANDERSON, AB .
JOURNAL OF CHEMICAL PHYSICS, 1975, 62 (03) :1187-1188
[8]   VIBRATIONAL FORCE CONSTANTS FROM ELECTRON DENSITIES [J].
ANDERSON, AB ;
PARR, RG .
JOURNAL OF CHEMICAL PHYSICS, 1970, 53 (08) :3375-&
[9]   MOLECULAR-ORBITAL THEORY OF BONDING IN FEO AND CHEMISORBED OXYGEN ON FE(100) [J].
ANDERSON, AB .
PHYSICAL REVIEW B, 1977, 16 (02) :900-905
[10]   THEORY OF UV SPECTRA FOR NI2 AND NI3 AND HYPOTHESIS FOR ARGON MATRIX FREQUENCY-SHIFTS FOR NI ATOMS [J].
ANDERSON, AB .
JOURNAL OF CHEMICAL PHYSICS, 1977, 66 (11) :5108-5111