Unexpected differential sensitivity of nuclear spin-spin-coupling constants to bond stretching in BH4-, NH4+, and SiH4

Journal of Chemical Physics

Volumn 113, Issue 8, 2000, Pages 3121-3129

  Sauer, Stephan P A ^a   Raynes, William T ^b  

^a UNIVERSITY OF COPENHAGEN   (Denmark)

^b UNIVERSITY OF SHEFFIELD   (United Kingdom)

Author keywords

[No Author keywords available]

Indexed keywords

APPROXIMATION THEORY; CHEMICAL BONDS; COMPUTER SIMULATION; CORRELATION METHODS; IONS; METHANE; SILANES;

BOND STRETCHING; NUCLEAR SPIN-SPIN COUPLING CONSTANTS; RANDOM PHASE APPROXIMATION; SELF CONSISTENT FIELD; SOFTWARE PACKAGE ACES2; SOFTWARE PACKAGE DALTON 1.1; UNEXPECTED DIFFERENTIAL SENSITIVITY;

BOND STRENGTH (CHEMICAL);

EID: 0034702622     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.1287277     Document Type: Article

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