TESTS OF CNDO METHOD FOR BAND-STRUCTURE OF CRYSTALLINE SOLIDS .1. CALCULATIONS ON LITHIUM-FLUORIDE

[1] Andre JM, 1971, CHEM PHYS LETT, V8, P195, DOI 10.1016/0009-2614(71)80012-X

[2] MOLECULAR-ORBITAL MODEL FOR KCL-TL [J]. PHYSICAL REVIEW B, 1971, 3 (11): : 3670 - &

[3] CALAIS JL, 1967, INT J QUANT CHEM S, V1, P661

[4] CLEMENTI E, 1971, RJ883 IBM RES REP

[5] On the electronic constitution of crystals, LiF and LiH [J]. PHYSICAL REVIEW, 1936, 50 (08): : 760 - 777

[6] GOURARY BS, 1960, SOLID STATE PHYS, V10, P127

[7] HALFMEISTER DW, 1965, J CHEM PHYS, V43, P795

[8] HAYNS MR, IN PRESS

[9] HERMAN F, 1968, METHODS COMPUTATIONA, V8, P193

[10] AN EXTENDED HUCKEL THEORY .I. HYDROCARBONS [J]. JOURNAL OF CHEMICAL PHYSICS, 1963, 39 (06) : 1397 - &

[1] Andre JM, 1971, CHEM PHYS LETT, V8, P195, DOI 10.1016/0009-2614(71)80012-X

[2] MOLECULAR-ORBITAL MODEL FOR KCL-TL [J]. PHYSICAL REVIEW B, 1971, 3 (11): : 3670 - &

[3] CALAIS JL, 1967, INT J QUANT CHEM S, V1, P661

[4] CLEMENTI E, 1971, RJ883 IBM RES REP

[5] On the electronic constitution of crystals, LiF and LiH [J]. PHYSICAL REVIEW, 1936, 50 (08): : 760 - 777

[6] GOURARY BS, 1960, SOLID STATE PHYS, V10, P127

[7] HALFMEISTER DW, 1965, J CHEM PHYS, V43, P795

[8] HAYNS MR, IN PRESS

[9] HERMAN F, 1968, METHODS COMPUTATIONA, V8, P193

[10] AN EXTENDED HUCKEL THEORY .I. HYDROCARBONS [J]. JOURNAL OF CHEMICAL PHYSICS, 1963, 39 (06) : 1397 - &