Predicting Atomic Charges in MOFs by Topological Charge Equilibration
Advanced Functional Materials, EarlyView.An atomic charge prediction method is presented that is able to accurately reproduce ab‐initio‐derived reference charges for a large number of metal–organic frameworks. Based on a topological charge equilibration scheme, static charges that fulfill overall neutrality are quickly generated.
Babak Farhadi Jahromi +2 more
wiley +1 more source
Behavioral and emotional problems and quality of life in Chinese children with Langerhans cell histiocytosis. [PDF]
BMC PediatrLi S +6 more
europepmc +1 more source
Efficacy of smartphone-based behavioral activation, assertiveness training, and problem-solving therapy for parenting stress in parents raising autistic children: a multicenter, randomized, open-label, parallel-group trial. [PDF]
BMC PsychiatryYamada A +11 more
europepmc +1 more source
A hybrid system for detecting semiconductor wafer defects using modified MobileNet with multi-head attention. [PDF]
PLoS OneDhar S +4 more
europepmc +1 more source
Racial Differences in Self-Reported Sleep Continuity Disturbance, Problem Endorsement, and Daytime Dysfunction Among Black and White Non-Hispanic Adults in the United States. [PDF]
Nat Sci SleepThompson MG +9 more
europepmc +1 more source
Exploring and explaining nurses' resilience and developing strategies for its enhancement: an explanatory sequential mixed method study. [PDF]
BMC NursKhaleghparast S +7 more
europepmc +1 more source
Problem centered inquiry and assessment in the context of liberal education
, 2014 Carol Geary Schneider
openalex +1 more source